Product OPENEYE NAME: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoro-2-nitro-phenoxy)propan-1-one
CAS Name: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoro-2-nitrophenoxy)-1-propanone
IUPAC NAME: (2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoro-2-nitrophenoxy)propan-1-one
SYSTEMATIC NAME: (2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoranyl-2-nitro-phenoxy)propan-1-one
MOLECULAR FORMULA: C17H17FN2O5
MOLECULAR WEIGHT: 348.325683
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC2=C(C=CC(=C2)F)[N+](=O)[O-]
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Product OPENEYE NAME: methyl 1-[(1R)-2-(3-acetylanilino)-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(2R)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C18H25N2O4+
MOLECULAR WEIGHT: 333.4021
SMILES: C[C@H](C(=O)NC1=CC=CC(=C1)C(=O)C)[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[(1R)-2-(3-acetylanilino)-1-methyl-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(2R)-1-[(3-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxylate
MOLECULAR FORMULA: C18H24N2O4
MOLECULAR WEIGHT: 332.39416
SMILES: C[C@H](C(=O)NC1=CC=CC(=C1)C(=O)C)N2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoro-2-nitro-phenoxy)propan-1-one
CAS Name: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoro-2-nitrophenoxy)-1-propanone
IUPAC NAME: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoro-2-nitrophenoxy)propan-1-one
SYSTEMATIC NAME: (2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(5-fluoranyl-2-nitro-phenoxy)propan-1-one
MOLECULAR FORMULA: C17H17FN2O5
MOLECULAR WEIGHT: 348.325683
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC2=C(C=CC(=C2)F)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[(Z)-(1-allyl-2-oxo-indolin-3-ylidene)amino]-3-methyl-thiourea
CAS Name: 1-methyl-3-[(Z)-(2-oxo-1-prop-2-enyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-methyl-3-[(Z)-(2-oxo-1-prop-2-enylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-methyl-3-[(Z)-(2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C13H14N4OS
MOLECULAR WEIGHT: 274.34146
SMILES: CNC(=S)N/N=C\1/C2=CC=CC=C2N(C1=O)CC=C
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Product OPENEYE NAME: methyl 1-[(1R)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(1R)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C22H26ClN2O4+
MOLECULAR WEIGHT: 417.90584
SMILES: COC1=C(C=C(C=C1)NC(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)OC)Cl
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Product OPENEYE NAME: methyl 1-[(1R)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl]piperidine-4-carboxylate
CAS Name: 1-[(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(1R)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C22H25ClN2O4
MOLECULAR WEIGHT: 416.8979
SMILES: COC1=C(C=C(C=C1)NC(=O)[C@@H](C2=CC=CC=C2)N3CCC(CC3)C(=O)OC)Cl
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Product OPENEYE NAME: 3-[2-(5-fluoro-2-nitro-phenoxy)acetyl]oxazolidin-2-one
CAS Name: 3-[2-(5-fluoro-2-nitrophenoxy)-1-oxoethyl]-2-oxazolidinone
IUPAC NAME: 3-[2-(5-fluoro-2-nitrophenoxy)acetyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3-[2-(5-fluoranyl-2-nitro-phenoxy)ethanoyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C11H9FN2O6
MOLECULAR WEIGHT: 284.197363
SMILES: C1COC(=O)N1C(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-]
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Product OPENEYE NAME: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenyl-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl] ester
IUPAC NAME: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(1S)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C25H21NO5
MOLECULAR WEIGHT: 415.43794
SMILES: COC1=CC=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: 1-[(Z)-(1-allyl-2-oxo-indolin-3-ylidene)amino]-3-butyl-thiourea
CAS Name: 1-butyl-3-[(Z)-(2-oxo-1-prop-2-enyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-butyl-3-[(Z)-(2-oxo-1-prop-2-enylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-butyl-3-[(Z)-(2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C16H20N4OS
MOLECULAR WEIGHT: 316.4212
SMILES: CCCCNC(=S)N/N=C\1/C2=CC=CC=C2N(C1=O)CC=C
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Product OPENEYE NAME: 4-[(5-fluoro-2-nitro-phenoxy)methyl]-2-(3-thienyl)thiazole
CAS Name: 4-[(5-fluoro-2-nitrophenoxy)methyl]-2-(3-thiophenyl)thiazole
IUPAC NAME: 4-[(5-fluoro-2-nitrophenoxy)methyl]-2-thiophen-3-yl-1,3-thiazole
SYSTEMATIC NAME: 4-[(5-fluoranyl-2-nitro-phenoxy)methyl]-2-thiophen-3-yl-1,3-thiazole
MOLECULAR FORMULA: C14H9FN2O3S2
MOLECULAR WEIGHT: 336.361263
SMILES: C1=CC(=C(C=C1F)OCC2=CSC(=N2)C3=CSC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: methyl 1-[(1S)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(1S)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C22H26ClN2O4+
MOLECULAR WEIGHT: 417.90584
SMILES: COC1=C(C=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)OC)Cl
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Product OPENEYE NAME: methyl 1-[(1S)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl]piperidine-4-carboxylate
CAS Name: 1-[(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(1S)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C22H25ClN2O4
MOLECULAR WEIGHT: 416.8979
SMILES: COC1=C(C=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)N3CCC(CC3)C(=O)OC)Cl
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Product OPENEYE NAME: 3-[(5-fluoro-2-nitro-phenoxy)methyl]-5-(4-fluorophenyl)-4-methyl-isoxazole
CAS Name: 3-[(5-fluoro-2-nitrophenoxy)methyl]-5-(4-fluorophenyl)-4-methylisoxazole
IUPAC NAME: 3-[(5-fluoro-2-nitrophenoxy)methyl]-5-(4-fluorophenyl)-4-methyl-1,2-oxazole
SYSTEMATIC NAME: 3-[(5-fluoranyl-2-nitro-phenoxy)methyl]-5-(4-fluorophenyl)-4-methyl-1,2-oxazole
MOLECULAR FORMULA: C17H12F2N2O4
MOLECULAR WEIGHT: 346.284986
SMILES: CC1=C(ON=C1COC2=C(C=CC(=C2)F)[N+](=O)[O-])C3=CC=C(C=C3)F
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Product OPENEYE NAME: methyl 1-[2-(2-benzoylanilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-(2-benzoylanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2-benzoylanilino)-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C22H25N2O4+
MOLECULAR WEIGHT: 381.4449
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: methyl 1-[2-(2-benzoylanilino)-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-(2-benzoylanilino)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2-benzoylanilino)-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C22H24N2O4
MOLECULAR WEIGHT: 380.43696
SMILES: COC(=O)C1CCN(CC1)CC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-[(Z)-(1-allyl-2-oxo-indolin-3-ylidene)amino]-3-ethyl-thiourea
CAS Name: 1-ethyl-3-[(Z)-(2-oxo-1-prop-2-enyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-ethyl-3-[(Z)-(2-oxo-1-prop-2-enylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-ethyl-3-[(Z)-(2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C14H16N4OS
MOLECULAR WEIGHT: 288.36804
SMILES: CCNC(=S)N/N=C\1/C2=CC=CC=C2N(C1=O)CC=C
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Product OPENEYE NAME: methyl 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C17H23N2O5+
MOLECULAR WEIGHT: 335.37492
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)OCCO3
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