Product OPENEYE NAME: (3Z)-3-[(4-octyl-2-pyridyl)hydrazono]naphthalen-2-one
CAS Name: (3Z)-3-[(4-octyl-2-pyridinyl)hydrazinylidene]-2-naphthalenone
IUPAC NAME: (3Z)-3-[(4-octylpyridin-2-yl)hydrazinylidene]naphthalen-2-one
SYSTEMATIC NAME: (3Z)-3-[(4-octylpyridin-2-yl)hydrazinylidene]naphthalen-2-one
MOLECULAR FORMULA: C23H27N3O
MOLECULAR WEIGHT: 361.47998
SMILES: CCCCCCCCC1=CC(=NC=C1)N/N=C\2/C=C3C=CC=CC3=CC2=O
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Product OPENEYE NAME: (3Z)-3-[(4-hexadecyl-2-pyridyl)hydrazono]naphthalen-2-one
CAS Name: (3Z)-3-[(4-hexadecyl-2-pyridinyl)hydrazinylidene]-2-naphthalenone
IUPAC NAME: (3Z)-3-[(4-hexadecylpyridin-2-yl)hydrazinylidene]naphthalen-2-one
SYSTEMATIC NAME: (3Z)-3-[(4-hexadecylpyridin-2-yl)hydrazinylidene]naphthalen-2-one
MOLECULAR FORMULA: C31H43N3O
MOLECULAR WEIGHT: 473.69262
SMILES: CCCCCCCCCCCCCCCCC1=CC(=NC=C1)N/N=C\2/C=C3C=CC=CC3=CC2=O
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Product OPENEYE NAME: butyl (NE)-N-tert-butoxycarbonyliminocarbamate
CAS Name: (NE)-N-[butoxy(oxo)methyl]iminocarbamic acid tert-butyl ester
IUPAC NAME: tert-butyl (NE)-N-butoxycarbonyliminocarbamate
SYSTEMATIC NAME: tert-butyl (NE)-N-butoxycarbonyliminocarbamate
MOLECULAR FORMULA: C10H18N2O4
MOLECULAR WEIGHT: 230.26092
SMILES: CCCCOC(=O)/N=N/C(=O)OC(C)(C)C
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Product OPENEYE NAME: (2Z)-2-(2-chloro-1-hydroxy-ethylidene)cyclopentanone
CAS Name: (2Z)-2-(2-chloro-1-hydroxyethylidene)-1-cyclopentanone
IUPAC NAME: (2Z)-2-(2-chloro-1-hydroxyethylidene)cyclopentan-1-one
SYSTEMATIC NAME: (2Z)-2-(2-chloranyl-1-oxidanyl-ethylidene)cyclopentan-1-one
MOLECULAR FORMULA: C7H9ClO2
MOLECULAR WEIGHT: 160.59816
SMILES: C1C/C(=C(\CCl)/O)/C(=O)C1
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Product OPENEYE NAME: 2-[(Z)-N-hydroxy-C-(trifluoromethyl)carbonimidoyl]cyclopentanone oxime
CAS Name: 2-[(1Z)-2,2,2-trifluoro-1-hydroxyiminoethyl]-1-cyclopentanone oxime
IUPAC NAME: (NZ)-N-[2-[(Z)-N-hydroxy-C-(trifluoromethyl)carbonimidoyl]cyclopentylidene]hydroxylamine
SYSTEMATIC NAME: (NZ)-N-[2-[(Z)-N-oxidanyl-C-(trifluoromethyl)carbonimidoyl]cyclopentylidene]hydroxylamine
MOLECULAR FORMULA: C7H9F3N2O2
MOLECULAR WEIGHT: 210.15377
SMILES: C1CC(/C(=N\O)/C1)/C(=N/O)/C(F)(F)F
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Product OPENEYE NAME: [6-[1,3-benzodioxol-5-yl-(3-methoxy-5-oxo-2H-furan-4-yl)methyl]-1,3-benzodioxol-5-yl] acetate
CAS Name: acetic acid [6-[1,3-benzodioxol-5-yl-(3-methoxy-5-oxo-2H-furan-4-yl)methyl]-1,3-benzodioxol-5-yl] ester
IUPAC NAME: [6-[1,3-benzodioxol-5-yl-(3-methoxy-5-oxo-2H-furan-4-yl)methyl]-1,3-benzodioxol-5-yl] acetate
SYSTEMATIC NAME: [6-[1,3-benzodioxol-5-yl-(3-methoxy-5-oxidanylidene-2H-furan-4-yl)methyl]-1,3-benzodioxol-5-yl] ethanoate
MOLECULAR FORMULA: C22H18O9
MOLECULAR WEIGHT: 426.37292
SMILES: CC(=O)OC1=CC2=C(C=C1C(C3=CC4=C(C=C3)OCO4)C5=C(COC5=O)OC)OCO2
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Product OPENEYE NAME: [6-[(3-methoxy-5-oxo-2H-furan-4-yl)-(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] acetate
CAS Name: acetic acid [6-[(3-methoxy-5-oxo-2H-furan-4-yl)-(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] ester
IUPAC NAME: [6-[(3-methoxy-5-oxo-2H-furan-4-yl)-(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] acetate
SYSTEMATIC NAME: [6-[(3-methoxy-5-oxidanylidene-2H-furan-4-yl)-(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl] ethanoate
MOLECULAR FORMULA: C22H20O8
MOLECULAR WEIGHT: 412.3894
SMILES: CC(=O)OC1=CC2=C(C=C1C(C3=CC=C(C=C3)OC)C4=C(COC4=O)OC)OCO2
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C21H20O8
MOLECULAR WEIGHT: 400.3787
SMILES: COC1=CC=CC(=C1OC)C2C3C(=O)OCC3(OC4=CC5=C(C=C24)OCO5)OC
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MOLECULAR FORMULA: C21H20O8
MOLECULAR WEIGHT: 400.3787
SMILES: COC1=C(C=C(C=C1)C2C3C(=O)OCC3(OC4=CC5=C(C=C24)OCO5)OC)OC
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C20H18O7
MOLECULAR WEIGHT: 370.35272
SMILES: COC1=CC=C(C=C1)C2C3C(=O)OCC3(OC4=CC5=C(C=C24)OCO5)OC
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MOLECULAR FORMULA: C20H18O7
MOLECULAR WEIGHT: 370.35272
SMILES: COC1=CC=CC(=C1)C2C3C(=O)OCC3(OC4=CC5=C(C=C24)OCO5)OC
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MOLECULAR FORMULA: C21H20O9
MOLECULAR WEIGHT: 416.3781
SMILES: COC1=CC(=CC(=C1OC)OC)[C@@H]2[C@@H]3C(=O)OC[C@]3(OC4=CC5=C(C=C24)OCO5)O
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MOLECULAR FORMULA: C22H22O9
MOLECULAR WEIGHT: 430.40468
SMILES: COC1=CC(=CC(=C1OC)OC)[C@@H]2[C@@H]3C(=O)OC[C@]3(OC4=CC5=C(C=C24)OCO5)OC
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Product OPENEYE NAME: 3,4-dihydro-2H-pyrrol-5-yl N,N-dimethylcarbamate
CAS Name: N,N-dimethylcarbamic acid 3,4-dihydro-2H-pyrrol-5-yl ester
IUPAC NAME: 3,4-dihydro-2H-pyrrol-5-yl N,N-dimethylcarbamate
SYSTEMATIC NAME: 3,4-dihydro-2H-pyrrol-5-yl N,N-dimethylcarbamate
MOLECULAR FORMULA: C7H12N2O2
MOLECULAR WEIGHT: 156.18238
SMILES: CN(C)C(=O)OC1=NCCC1
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Product OPENEYE NAME: ethyl (Z,4R)-4-benzyloxy-4-[(2R,3R,4S)-3-benzyloxy-4-hydroxy-tetrahydrothiophen-2-yl]but-2-enoate
CAS Name: (Z,4R)-4-[(2R,3R,4S)-4-hydroxy-3-phenylmethoxy-2-thiolanyl]-4-phenylmethoxy-2-butenoic acid ethyl ester
IUPAC NAME: ethyl (Z,4R)-4-[(2R,3R,4S)-4-hydroxy-3-phenylmethoxythiolan-2-yl]-4-phenylmethoxybut-2-enoate
SYSTEMATIC NAME: ethyl (Z,4R)-4-[(2R,3R,4S)-4-oxidanyl-3-phenylmethoxy-thiolan-2-yl]-4-phenylmethoxy-but-2-enoate
MOLECULAR FORMULA: C24H28O5S
MOLECULAR WEIGHT: 428.54112
SMILES: CCOC(=O)/C=C\[C@H]([C@@H]1[C@@H]([C@@H](CS1)O)OCC2=CC=CC=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: (2R,4aR,6S,7S,8R,8aS)-7-benzyloxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol
CAS Name: (2R,4aR,6S,7S,8R,8aS)-6-methoxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol
IUPAC NAME: (2R,4aR,6S,7S,8R,8aS)-6-methoxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol
SYSTEMATIC NAME: (2R,4aR,6S,7S,8R,8aS)-6-methoxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol
MOLECULAR FORMULA: C21H24O6
MOLECULAR WEIGHT: 372.41166
SMILES: CO[C@@H]1[C@H]([C@@H]([C@H]2[C@H](O1)CO[C@H](O2)C3=CC=CC=C3)O)OCC4=CC=CC=C4
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Product OPENEYE NAME: ethyl (Z)-3-amino-2-(phenylcarbamoyl)but-2-enoate
CAS Name: (Z)-3-amino-2-[anilino(oxo)methyl]-2-butenoic acid ethyl ester
IUPAC NAME: ethyl (Z)-3-amino-2-(phenylcarbamoyl)but-2-enoate
SYSTEMATIC NAME: ethyl (Z)-3-azanyl-2-(phenylcarbamoyl)but-2-enoate
MOLECULAR FORMULA: C13H16N2O3
MOLECULAR WEIGHT: 248.27774
SMILES: CCOC(=O)/C(=C(/C)\N)/C(=O)NC1=CC=CC=C1
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