Product OPENEYE NAME: N-(3-aminopropyl)-N'-[3-(3-aminopropylamino)propyl]butane-1,4-diamine
CAS Name: N-(3-aminopropyl)-N'-[3-(3-aminopropylamino)propyl]butane-1,4-diamine
IUPAC NAME: N-(3-aminopropyl)-N'-[3-(3-aminopropylamino)propyl]butane-1,4-diamine
SYSTEMATIC NAME: N-(3-azanylpropyl)-N'-[3-(3-azanylpropylamino)propyl]butane-1,4-diamine
MOLECULAR FORMULA: C13H33N5
MOLECULAR WEIGHT: 259.43462
SMILES: C(CCNCCCNCCCN)CNCCCN
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Product OPENEYE NAME: N'-[4-[4-(4-aminobutylamino)butylamino]butyl]butane-1,4-diamine
CAS Name: N'-[4-[4-(4-aminobutylamino)butylamino]butyl]butane-1,4-diamine
IUPAC NAME: N'-[4-[4-(4-aminobutylamino)butylamino]butyl]butane-1,4-diamine
SYSTEMATIC NAME: N'-[4-[4-(4-azanylbutylamino)butylamino]butyl]butane-1,4-diamine
MOLECULAR FORMULA: C16H39N5
MOLECULAR WEIGHT: 301.51436
SMILES: C(CCNCCCCNCCCCNCCCCN)CN
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Product OPENEYE NAME: tert-butyl 2-[4-[4-(2-tert-butoxy-2-oxo-ethoxy)phenyl]sulfonylphenoxy]acetate
CAS Name: 2-[4-[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]phenyl]sulfonylphenoxy]acetic acid tert-butyl ester
IUPAC NAME: tert-butyl 2-[4-[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]phenyl]sulfonylphenoxy]acetate
SYSTEMATIC NAME: tert-butyl 2-[4-[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]phenyl]sulfonylphenoxy]ethanoate
MOLECULAR FORMULA: C24H30O8S
MOLECULAR WEIGHT: 478.5552
SMILES: CC(C)(C)OC(=O)COC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OCC(=O)OC(C)(C)C
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Product OPENEYE NAME: dimethyl cyclohexene-1,4-dicarboxylate
CAS Name: cyclohexene-1,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl cyclohexene-1,4-dicarboxylate
SYSTEMATIC NAME: dimethyl cyclohexene-1,4-dicarboxylate
MOLECULAR FORMULA: C10H14O4
MOLECULAR WEIGHT: 198.21576
SMILES: COC(=O)C1CCC(=CC1)C(=O)OC
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Product OPENEYE NAME: tert-butyl-[2-(1H-indol-3-yl)ethoxy]-dimethyl-silane
CAS Name: tert-butyl-[2-(1H-indol-3-yl)ethoxy]-dimethylsilane
IUPAC NAME: tert-butyl-[2-(1H-indol-3-yl)ethoxy]-dimethylsilane
SYSTEMATIC NAME: tert-butyl-[2-(1H-indol-3-yl)ethoxy]-dimethyl-silane
MOLECULAR FORMULA: C16H25NOSi
MOLECULAR WEIGHT: 275.4613
SMILES: CC(C)(C)[Si](C)(C)OCCC1=CNC2=CC=CC=C21
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Product OPENEYE NAME: 1-indol-1-ylpent-4-yn-1-one
CAS Name: 1-(1-indolyl)-4-pentyn-1-one
IUPAC NAME: 1-indol-1-ylpent-4-yn-1-one
SYSTEMATIC NAME: 1-indol-1-ylpent-4-yn-1-one
MOLECULAR FORMULA: C13H11NO
MOLECULAR WEIGHT: 197.23254
SMILES: C#CCCC(=O)N1C=CC2=CC=CC=C21
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Product OPENEYE NAME: triazolo[1,5-a]quinazoline
CAS Name: triazolo[1,5-a]quinazoline
IUPAC NAME: triazolo[1,5-a]quinazoline
SYSTEMATIC NAME: [1,2,3]triazolo[1,5-a]quinazoline
MOLECULAR FORMULA: C9H6N4
MOLECULAR WEIGHT: 170.17074
SMILES: C1=CC=C2C(=C1)C=NC3=CN=NN23
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Product OPENEYE NAME: 5-phenyltriazolo[1,5-a]quinazoline
CAS Name: 5-phenyltriazolo[1,5-a]quinazoline
IUPAC NAME: 5-phenyltriazolo[1,5-a]quinazoline
SYSTEMATIC NAME: 5-phenyl-[1,2,3]triazolo[1,5-a]quinazoline
MOLECULAR FORMULA: C15H10N4
MOLECULAR WEIGHT: 246.2667
SMILES: C1=CC=C(C=C1)C2=NC3=CN=NN3C4=CC=CC=C42
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Product OPENEYE NAME: (2Z)-2-(2,3,4,9-tetrahydropyrido[3,4-b]indol-1-ylidene)acetamide
CAS Name: (2Z)-2-(2,3,4,9-tetrahydropyrido[3,4-b]indol-1-ylidene)acetamide
IUPAC NAME: (2Z)-2-(2,3,4,9-tetrahydropyrido[3,4-b]indol-1-ylidene)acetamide
SYSTEMATIC NAME: (2Z)-2-(2,3,4,9-tetrahydropyrido[3,4-b]indol-1-ylidene)ethanamide
MOLECULAR FORMULA: C13H13N3O
MOLECULAR WEIGHT: 227.26182
SMILES: C1CN/C(=C\C(=O)N)/C2=C1C3=CC=CC=C3N2
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Product OPENEYE NAME: N-methyl-N-(oxiran-2-ylmethyl)cyclohexanamine
CAS Name: N-methyl-N-(2-oxiranylmethyl)cyclohexanamine
IUPAC NAME: N-methyl-N-(oxiran-2-ylmethyl)cyclohexanamine
SYSTEMATIC NAME: N-methyl-N-(oxiran-2-ylmethyl)cyclohexanamine
MOLECULAR FORMULA: C10H19NO
MOLECULAR WEIGHT: 169.26396
SMILES: CN(CC1CO1)C2CCCCC2
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Product OPENEYE NAME: 2-carboxy-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizin-5-ium-3-carboxylate
CAS Name: 2-carboxy-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizin-5-ium-3-carboxylate
IUPAC NAME: 2-carboxy-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizin-5-ium-3-carboxylate
SYSTEMATIC NAME: 2-carboxy-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizin-5-ium-3-carboxylate
MOLECULAR FORMULA: C16H11NO6
MOLECULAR WEIGHT: 313.26164
SMILES: C1C[N+]2=C(C=C(C(=C2)C(=O)[O-])C(=O)O)C3=CC4=C(C=C31)OCO4
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Product OPENEYE NAME: 1-(1,3-benzothiazol-2-yl)butan-2-ol
CAS Name: 1-(1,3-benzothiazol-2-yl)-2-butanol
IUPAC NAME: 1-(1,3-benzothiazol-2-yl)butan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzothiazol-2-yl)butan-2-ol
MOLECULAR FORMULA: C11H13NOS
MOLECULAR WEIGHT: 207.29202
SMILES: CCC(CC1=NC2=CC=CC=C2S1)O
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Product OPENEYE NAME: 1-(1,3-benzothiazol-2-yl)-2-phenyl-propan-2-ol
CAS Name: 1-(1,3-benzothiazol-2-yl)-2-phenyl-2-propanol
IUPAC NAME: 1-(1,3-benzothiazol-2-yl)-2-phenylpropan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzothiazol-2-yl)-2-phenyl-propan-2-ol
MOLECULAR FORMULA: C16H15NOS
MOLECULAR WEIGHT: 269.3614
SMILES: CC(CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)O
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Product OPENEYE NAME: 1-(1,3-benzothiazol-2-yl)-2-methyl-octan-2-ol
CAS Name: 1-(1,3-benzothiazol-2-yl)-2-methyl-2-octanol
IUPAC NAME: 1-(1,3-benzothiazol-2-yl)-2-methyloctan-2-ol
SYSTEMATIC NAME: 1-(1,3-benzothiazol-2-yl)-2-methyl-octan-2-ol
MOLECULAR FORMULA: C16H23NOS
MOLECULAR WEIGHT: 277.42492
SMILES: CCCCCCC(C)(CC1=NC2=CC=CC=C2S1)O
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Product OPENEYE NAME: 1-(1,3-benzothiazol-2-yl)-2-methyl-but-3-en-2-ol
CAS Name: 1-(1,3-benzothiazol-2-yl)-2-methyl-3-buten-2-ol
IUPAC NAME: 1-(1,3-benzothiazol-2-yl)-2-methylbut-3-en-2-ol
SYSTEMATIC NAME: 1-(1,3-benzothiazol-2-yl)-2-methyl-but-3-en-2-ol
MOLECULAR FORMULA: C12H13NOS
MOLECULAR WEIGHT: 219.30272
SMILES: CC(CC1=NC2=CC=CC=C2S1)(C=C)O
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Product OPENEYE NAME: 2-(2-methyltetrahydrofuran-2-yl)acetaldehyde
CAS Name: 2-(2-methyl-2-oxolanyl)acetaldehyde
IUPAC NAME: 2-(2-methyloxolan-2-yl)acetaldehyde
SYSTEMATIC NAME: 2-(2-methyloxolan-2-yl)ethanal
MOLECULAR FORMULA: C7H12O2
MOLECULAR WEIGHT: 128.16898
SMILES: CC1(CCCO1)CC=O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: CC12C3CCC1CC(C3)O2
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Product OPENEYE NAME: 1-methyl-3-[1-(3-methylphenoxy)ethoxy]benzene
CAS Name: 1-methyl-3-[1-(3-methylphenoxy)ethoxy]benzene
IUPAC NAME: 1-methyl-3-[1-(3-methylphenoxy)ethoxy]benzene
SYSTEMATIC NAME: 1-methyl-3-[1-(3-methylphenoxy)ethoxy]benzene
MOLECULAR FORMULA: C16H18O2
MOLECULAR WEIGHT: 242.31292
SMILES: CC1=CC(=CC=C1)OC(C)OC2=CC=CC(=C2)C
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Product OPENEYE NAME: 1-chloro-4-[1-(4-chlorophenoxy)ethoxy]benzene
CAS Name: 1-chloro-4-[1-(4-chlorophenoxy)ethoxy]benzene
IUPAC NAME: 1-chloro-4-[1-(4-chlorophenoxy)ethoxy]benzene
SYSTEMATIC NAME: 1-chloranyl-4-[1-(4-chloranylphenoxy)ethoxy]benzene
MOLECULAR FORMULA: C14H12Cl2O2
MOLECULAR WEIGHT: 283.14988
SMILES: CC(OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 4-benzyl-2-methyl-1H-pyrrole
CAS Name: 2-methyl-4-(phenylmethyl)-1H-pyrrole
IUPAC NAME: 4-benzyl-2-methyl-1H-pyrrole
SYSTEMATIC NAME: 2-methyl-4-(phenylmethyl)-1H-pyrrole
MOLECULAR FORMULA: C12H13N
MOLECULAR WEIGHT: 171.23832
SMILES: CC1=CC(=CN1)CC2=CC=CC=C2
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