Product OPENEYE NAME: heptane; titanium(2+)
CAS Name: heptane; titanium(2+)
IUPAC NAME: heptane; titanium(2+)
SYSTEMATIC NAME: heptane; titanium(2+)
MOLECULAR FORMULA: C7H16Ti+2
MOLECULAR WEIGHT: 148.06894
SMILES: CCCCCCC.[Ti+2]
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Product OPENEYE NAME: 6-methylheptyl N-(oxomethylene)carbamate
CAS Name: N-(oxomethylidene)carbamic acid 6-methylheptyl ester
IUPAC NAME: 6-methylheptyl N-(oxomethylidene)carbamate
SYSTEMATIC NAME: 6-methylheptyl N-(oxidanylidenemethylidene)carbamate
MOLECULAR FORMULA: C10H17NO3
MOLECULAR WEIGHT: 199.24688
SMILES: CC(C)CCCCCOC(=O)N=C=O
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Product OPENEYE NAME: hexyl(triisocyanato)silane
CAS Name: hexyl(triisocyanato)silane
IUPAC NAME: hexyl(triisocyanato)silane
SYSTEMATIC NAME: hexyl(triisocyanato)silane
MOLECULAR FORMULA: C9H13N3O3Si
MOLECULAR WEIGHT: 239.30332
SMILES: CCCCCC[Si](N=C=O)(N=C=O)N=C=O
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Product OPENEYE NAME: diisocyanato(isopropyl)silicon
CAS Name: diisocyanato(propan-2-yl)silicon
IUPAC NAME: diisocyanato(propan-2-yl)silicon
SYSTEMATIC NAME: diisocyanato(propan-2-yl)silicon
MOLECULAR FORMULA: C5H7N2O2Si
MOLECULAR WEIGHT: 155.20678
SMILES: CC(C)[Si](N=C=O)N=C=O
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Product OPENEYE NAME: butan-1-ol; 3-methylheptane
CAS Name: 1-butanol; 3-methylheptane
IUPAC NAME: butan-1-ol; 3-methylheptane
SYSTEMATIC NAME: butan-1-ol; 3-methylheptane
MOLECULAR FORMULA: C12H28O
MOLECULAR WEIGHT: 188.35012
SMILES: CCCCC(C)CC.CCCCO
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Product OPENEYE NAME: methyl 6-(2-hydroxyethylamino)-6-oxo-hexanoate
CAS Name: 6-(2-hydroxyethylamino)-6-oxohexanoic acid methyl ester
IUPAC NAME: methyl 6-(2-hydroxyethylamino)-6-oxohexanoate
SYSTEMATIC NAME: methyl 6-(2-hydroxyethylamino)-6-oxidanylidene-hexanoate
MOLECULAR FORMULA: C9H17NO4
MOLECULAR WEIGHT: 203.23558
SMILES: COC(=O)CCCCC(=O)NCCO
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Product OPENEYE NAME: 2-isobutyl-4-methyl-pentane-1,2-diamine
CAS Name: 4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
IUPAC NAME: 4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
SYSTEMATIC NAME: 4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
MOLECULAR FORMULA: C10H24N2
MOLECULAR WEIGHT: 172.31096
SMILES: CC(C)CC(CC(C)C)(CN)N
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Product OPENEYE NAME: 1-[(5,6-dichlorotriazin-4-yl)amino]anthracene-9,10-dione
CAS Name: 1-[(5,6-dichloro-4-triazinyl)amino]anthracene-9,10-dione
IUPAC NAME: 1-[(5,6-dichlorotriazin-4-yl)amino]anthracene-9,10-dione
SYSTEMATIC NAME: 1-[[5,6-bis(chloranyl)-1,2,3-triazin-4-yl]amino]anthracene-9,10-dione
MOLECULAR FORMULA: C17H8Cl2N4O2
MOLECULAR WEIGHT: 371.17702
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=C(C(=NN=N4)Cl)Cl
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Product OPENEYE NAME: 1-(4-amino-3-methyl-phenyl)ethenesulfinic acid
CAS Name: 1-(4-amino-3-methylphenyl)ethenesulfinic acid
IUPAC NAME: 1-(4-amino-3-methylphenyl)ethenesulfinic acid
SYSTEMATIC NAME: 1-(4-azanyl-3-methyl-phenyl)ethenesulfinic acid
MOLECULAR FORMULA: C9H11NO2S
MOLECULAR WEIGHT: 197.25414
SMILES: CC1=C(C=CC(=C1)C(=C)S(=O)O)N
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Product OPENEYE NAME: 2-(2-methylsulfanyl-4-oxo-thieno[3,2-d]pyrimidin-3-yl)acetic acid
CAS Name: 2-[2-(methylthio)-4-oxo-3-thieno[3,2-d]pyrimidinyl]acetic acid
IUPAC NAME: 2-(2-methylsulfanyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetic acid
SYSTEMATIC NAME: 2-(2-methylsulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl)ethanoic acid
MOLECULAR FORMULA: C9H8N2O3S2
MOLECULAR WEIGHT: 256.30142
SMILES: CSC1=NC2=C(C(=O)N1CC(=O)O)SC=C2
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Product OPENEYE NAME: acetic acid; 1H-thieno[3,2-d]pyrimidin-4-one
CAS Name: acetic acid; 1H-thieno[3,2-d]pyrimidin-4-one
IUPAC NAME: acetic acid; 1H-thieno[3,2-d]pyrimidin-4-one
SYSTEMATIC NAME: ethanoic acid; 1H-thieno[3,2-d]pyrimidin-4-one
MOLECULAR FORMULA: C8H8N2O3S
MOLECULAR WEIGHT: 212.22572
SMILES: CC(=O)O.C1=CSC2=C1NC=NC2=O
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