Product OPENEYE NAME: [2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 4-phenylbutanoate
CAS Name: 4-phenylbutanoic acid [2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester
IUPAC NAME: [2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 4-phenylbutanoate
SYSTEMATIC NAME: (2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 4-phenylbutanoate
MOLECULAR FORMULA: C19H26N2O3
MOLECULAR WEIGHT: 330.42134
SMILES: C1CCN(C1)C(=O)C2CCCN2OC(=O)CCCC3=CC=CC=C3
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Product OPENEYE NAME: [(1-carboxy-2-hydroxy-ethyl)amino]-(2,3-dihydroxypropyl)-oxo-phosphonium
CAS Name: [(1-carboxy-2-hydroxyethyl)amino]-(2,3-dihydroxypropyl)-oxophosphonium
IUPAC NAME: [(1-carboxy-2-hydroxyethyl)amino]-(2,3-dihydroxypropyl)-oxophosphanium
SYSTEMATIC NAME: [[1,3-bis(oxidanyl)-1-oxidanylidene-propan-2-yl]amino]-[2,3-bis(oxidanyl)propyl]-oxidanylidene-phosphanium
MOLECULAR FORMULA: C6H13NO6P+
MOLECULAR WEIGHT: 226.144281
SMILES: C(C(C[P+](=O)NC(CO)C(=O)O)O)O
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Product OPENEYE NAME: tris[1,2-bis(2,4-ditert-butylphenyl)-3-methyl-cyclobutyl] phosphite
CAS Name: phosphorous acid tris[1,2-bis(2,4-ditert-butylphenyl)-3-methylcyclobutyl] ester
IUPAC NAME: tris[1,2-bis(2,4-ditert-butylphenyl)-3-methylcyclobutyl] phosphite
SYSTEMATIC NAME: tris[1,2-bis(2,4-ditert-butylphenyl)-3-methyl-cyclobutyl] phosphite
MOLECULAR FORMULA: C99H147O3P
MOLECULAR WEIGHT: 1416.198441
SMILES: CC1CC(C1C2=C(C=C(C=C2)C(C)(C)C)C(C)(C)C)(C3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)OP(OC4(CC(C4C5=C(C=C(C=C5)C(C)(C)C)C(C)(C)C)C)C6=C(C=C(C=C6)C(C)(C)C)C(C)(C)C)OC7(CC(C7C8=C(C=C(C=C8)C(C)(C)C)C(C)(C)C)C)C9=C(C=C(C=C9)C(C)(C)C)C(C)(C)C
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Product OPENEYE NAME: 4-methylbenzenesulfonic acid; 3-piperazin-1-ylpropan-1-amine
CAS Name: 4-methylbenzenesulfonic acid; 3-(1-piperazinyl)-1-propanamine
IUPAC NAME: 4-methylbenzenesulfonic acid; 3-piperazin-1-ylpropan-1-amine
SYSTEMATIC NAME: 4-methylbenzenesulfonic acid; 3-piperazin-1-ylpropan-1-amine
MOLECULAR FORMULA: C14H25N3O3S
MOLECULAR WEIGHT: 315.4316
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(CCN1)CCCN
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Product OPENEYE NAME: 4-methylbenzenesulfonic acid; N'-methylpropane-1,3-diamine
CAS Name: 4-methylbenzenesulfonic acid; N'-methylpropane-1,3-diamine
IUPAC NAME: 4-methylbenzenesulfonic acid; N'-methylpropane-1,3-diamine
SYSTEMATIC NAME: 4-methylbenzenesulfonic acid; N'-methylpropane-1,3-diamine
MOLECULAR FORMULA: C11H20N2O3S
MOLECULAR WEIGHT: 260.3531
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.CNCCCN
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Product OPENEYE NAME: 1,3-diaminobutan-1-ol
CAS Name: 1,3-diamino-1-butanol
IUPAC NAME: 1,3-diaminobutan-1-ol
SYSTEMATIC NAME: 1,3-bis(azanyl)butan-1-ol
MOLECULAR FORMULA: C4H12N2O
MOLECULAR WEIGHT: 104.15088
SMILES: CC(CC(N)O)N
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Product OPENEYE NAME: 4-methylbenzenesulfonic acid; 2-piperazin-1-ylethanamine
CAS Name: 4-methylbenzenesulfonic acid; 2-(1-piperazinyl)ethanamine
IUPAC NAME: 4-methylbenzenesulfonic acid; 2-piperazin-1-ylethanamine
SYSTEMATIC NAME: 4-methylbenzenesulfonic acid; 2-piperazin-1-ylethanamine
MOLECULAR FORMULA: C13H23N3O3S
MOLECULAR WEIGHT: 301.40502
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(CCN1)CCN
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Product OPENEYE NAME: N'-butylmethanediamine; N'-methylethane-1,2-diamine
CAS Name: N'-butylmethanediamine; N'-methylethane-1,2-diamine
IUPAC NAME: N'-butylmethanediamine; N'-methylethane-1,2-diamine
SYSTEMATIC NAME: N'-butylmethanediamine; N'-methylethane-1,2-diamine
MOLECULAR FORMULA: C8H24N4
MOLECULAR WEIGHT: 176.30296
SMILES: CCCCNCN.CNCCN
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Product OPENEYE NAME: N'-butylmethanediamine
CAS Name: N'-butylmethanediamine
IUPAC NAME: N'-butylmethanediamine
SYSTEMATIC NAME: N'-butylmethanediamine
MOLECULAR FORMULA: C5H14N2
MOLECULAR WEIGHT: 102.17806
SMILES: CCCCNCN
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Product OPENEYE NAME: 2-[3-[(4Z)-4-amino-4-hydroxyimino-butyl]phenoxy]acetate
CAS Name: 2-[3-[(4Z)-4-amino-4-hydroxyiminobutyl]phenoxy]acetate
IUPAC NAME: 2-[3-[(4Z)-4-amino-4-hydroxyiminobutyl]phenoxy]acetate
SYSTEMATIC NAME: 2-[3-[(4Z)-4-azanyl-4-hydroxyimino-butyl]phenoxy]ethanoate
MOLECULAR FORMULA: C12H15N2O4-
MOLECULAR WEIGHT: 251.2585
SMILES: C1=CC(=CC(=C1)OCC(=O)[O-])CCC/C(=N/O)/N
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Product OPENEYE NAME: 2-[3-[(4Z)-4-amino-4-hydroxyimino-butyl]phenoxy]acetic acid
CAS Name: 2-[3-[(4Z)-4-amino-4-hydroxyiminobutyl]phenoxy]acetic acid
IUPAC NAME: 2-[3-[(4Z)-4-amino-4-hydroxyiminobutyl]phenoxy]acetic acid
SYSTEMATIC NAME: 2-[3-[(4Z)-4-azanyl-4-hydroxyimino-butyl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C12H16N2O4
MOLECULAR WEIGHT: 252.26644
SMILES: C1=CC(=CC(=C1)OCC(=O)O)CCC/C(=N/O)/N
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Product OPENEYE NAME: 2-[(benzhydrylideneamino)carbamoyl]-2-phenoxy-butanoic acid
CAS Name: 2-[[2-(diphenylmethylene)hydrazinyl]-oxomethyl]-2-phenoxybutanoic acid
IUPAC NAME: 2-[(benzhydrylideneamino)carbamoyl]-2-phenoxybutanoic acid
SYSTEMATIC NAME: 2-[[(diphenylmethylidene)amino]carbamoyl]-2-phenoxy-butanoic acid
MOLECULAR FORMULA: C24H22N2O4
MOLECULAR WEIGHT: 402.44248
SMILES: CCC(C(=O)NN=C(C1=CC=CC=C1)C2=CC=CC=C2)(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: 2-[(benzhydrylideneamino)sulfamoyl]-2-phenoxy-pentanoic acid
CAS Name: 2-[[(diphenylmethylene)amino]sulfamoyl]-2-phenoxypentanoic acid
IUPAC NAME: 2-[(benzhydrylideneamino)sulfamoyl]-2-phenoxypentanoic acid
SYSTEMATIC NAME: 2-[[(diphenylmethylidene)amino]sulfamoyl]-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C24H24N2O5S
MOLECULAR WEIGHT: 452.52276
SMILES: CCCC(C(=O)O)(OC1=CC=CC=C1)S(=O)(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 5-(dibenzylamino)-5-oxo-2-phenoxy-pentanoic acid
CAS Name: 5-[bis(phenylmethyl)amino]-5-oxo-2-phenoxypentanoic acid
IUPAC NAME: 5-(dibenzylamino)-5-oxo-2-phenoxypentanoic acid
SYSTEMATIC NAME: 5-[bis(phenylmethyl)amino]-5-oxidanylidene-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C25H25NO4
MOLECULAR WEIGHT: 403.4703
SMILES: C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)CCC(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: O1-[(Z)-1,2-diphenylethylideneamino] O3-propyl 2-phenoxypropanedioate
CAS Name: 2-phenoxypropanedioic acid O1-[(Z)-1,2-diphenylethylideneamino] ester O3-propyl ester
IUPAC NAME: 1-O-[(Z)-1,2-diphenylethylideneamino] 3-O-propyl 2-phenoxypropanedioate
SYSTEMATIC NAME: O1-[(Z)-1,2-diphenylethylideneamino] O3-propyl 2-phenoxypropanedioate
MOLECULAR FORMULA: C26H25NO5
MOLECULAR WEIGHT: 431.4804
SMILES: CCCOC(=O)C(C(=O)O/N=C(/CC1=CC=CC=C1)\C2=CC=CC=C2)OC3=CC=CC=C3
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Product OPENEYE NAME: (E)-2-phenoxy-2-[phenyl(3-pyridyl)methyl]-5-pyrazol-1-yl-pent-3-enoic acid
CAS Name: (E)-2-phenoxy-2-[phenyl(3-pyridinyl)methyl]-5-(1-pyrazolyl)-3-pentenoic acid
IUPAC NAME: (E)-2-phenoxy-2-[phenyl(pyridin-3-yl)methyl]-5-pyrazol-1-ylpent-3-enoic acid
SYSTEMATIC NAME: (E)-2-phenoxy-2-[phenyl(pyridin-3-yl)methyl]-5-pyrazol-1-yl-pent-3-enoic acid
MOLECULAR FORMULA: C26H23N3O3
MOLECULAR WEIGHT: 425.47912
SMILES: C1=CC=C(C=C1)C(C2=CN=CC=C2)C(/C=C/CN3C=CC=N3)(C(=O)O)OC4=CC=CC=C4
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