Product OPENEYE NAME: (3-carboxy-2-heptoxy-5-methyl-4-oxo-hexyl)-trimethyl-ammonium
CAS Name: (3-carboxy-2-heptoxy-5-methyl-4-oxohexyl)-trimethylammonium
IUPAC NAME: (3-carboxy-2-heptoxy-5-methyl-4-oxohexyl)-trimethylazanium
SYSTEMATIC NAME: (3-carboxy-2-heptoxy-5-methyl-4-oxidanylidene-hexyl)-trimethyl-azanium
MOLECULAR FORMULA: C18H36NO4+
MOLECULAR WEIGHT: 330.48274
SMILES: CCCCCCCOC(C[N+](C)(C)C)C(C(=O)C(C)C)C(=O)O
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Product OPENEYE NAME: 3-heptoxy-4-(trimethylammonio)butanoate
CAS Name: 3-heptoxy-4-(trimethylammonio)butanoate
IUPAC NAME: 3-heptoxy-4-(trimethylazaniumyl)butanoate
SYSTEMATIC NAME: 3-heptoxy-4-(trimethylazaniumyl)butanoate
MOLECULAR FORMULA: C14H29NO3
MOLECULAR WEIGHT: 259.38496
SMILES: CCCCCCCOC(CC(=O)[O-])C[N+](C)(C)C
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Product OPENEYE NAME: (3-carboxy-2-heptoxy-propyl)-trimethyl-ammonium
CAS Name: (3-carboxy-2-heptoxypropyl)-trimethylammonium
IUPAC NAME: (3-carboxy-2-heptoxypropyl)-trimethylazanium
SYSTEMATIC NAME: (2-heptoxy-4-oxidanyl-4-oxidanylidene-butyl)-trimethyl-azanium
MOLECULAR FORMULA: C14H30NO3+
MOLECULAR WEIGHT: 260.3929
SMILES: CCCCCCCOC(CC(=O)O)C[N+](C)(C)C
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Product OPENEYE NAME: 2-[1-butoxy-2-(trimethylammonio)ethyl]-4-methyl-3-oxo-pentanoate
CAS Name: 2-[1-butoxy-2-(trimethylammonio)ethyl]-4-methyl-3-oxopentanoate
IUPAC NAME: 2-[1-butoxy-2-(trimethylazaniumyl)ethyl]-4-methyl-3-oxopentanoate
SYSTEMATIC NAME: 2-[1-butoxy-2-(trimethylazaniumyl)ethyl]-4-methyl-3-oxidanylidene-pentanoate
MOLECULAR FORMULA: C15H29NO4
MOLECULAR WEIGHT: 287.39506
SMILES: CCCCOC(C[N+](C)(C)C)C(C(=O)C(C)C)C(=O)[O-]
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Product OPENEYE NAME: (2-butoxy-3-carboxy-5-methyl-4-oxo-hexyl)-trimethyl-ammonium
CAS Name: (2-butoxy-3-carboxy-5-methyl-4-oxohexyl)-trimethylammonium
IUPAC NAME: (2-butoxy-3-carboxy-5-methyl-4-oxohexyl)-trimethylazanium
SYSTEMATIC NAME: (2-butoxy-3-carboxy-5-methyl-4-oxidanylidene-hexyl)-trimethyl-azanium
MOLECULAR FORMULA: C15H30NO4+
MOLECULAR WEIGHT: 288.403
SMILES: CCCCOC(C[N+](C)(C)C)C(C(=O)C(C)C)C(=O)O
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Product OPENEYE NAME: 3-butoxy-4-(trimethylammonio)butanoate
CAS Name: 3-butoxy-4-(trimethylammonio)butanoate
IUPAC NAME: 3-butoxy-4-(trimethylazaniumyl)butanoate
SYSTEMATIC NAME: 3-butoxy-4-(trimethylazaniumyl)butanoate
MOLECULAR FORMULA: C11H23NO3
MOLECULAR WEIGHT: 217.30522
SMILES: CCCCOC(CC(=O)[O-])C[N+](C)(C)C
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Product OPENEYE NAME: (2-butoxy-3-carboxy-propyl)-trimethyl-ammonium
CAS Name: (2-butoxy-3-carboxypropyl)-trimethylammonium
IUPAC NAME: (2-butoxy-3-carboxypropyl)-trimethylazanium
SYSTEMATIC NAME: (2-butoxy-4-oxidanyl-4-oxidanylidene-butyl)-trimethyl-azanium
MOLECULAR FORMULA: C11H24NO3+
MOLECULAR WEIGHT: 218.31316
SMILES: CCCCOC(CC(=O)O)C[N+](C)(C)C
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Product OPENEYE NAME: 5-amino-6-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-1,3-dipropyl-pyrimidine-2,4-dione
CAS Name: 5-amino-6-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-1,3-dipropylpyrimidine-2,4-dione
IUPAC NAME: 5-amino-6-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-1,3-dipropylpyrimidine-2,4-dione
SYSTEMATIC NAME: 5-azanyl-6-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-1,3-dipropyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C21H27N3O5
MOLECULAR WEIGHT: 401.45618
SMILES: CCCN1C(=C(C(=O)N(C1=O)CCC)N)C(=O)/C=C/C2=CC(=C(C=C2)OC)OC
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Product OPENEYE NAME: 5-amino-6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1,3-dipropyl-pyrimidine-2,4-dione
CAS Name: 5-amino-6-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-1,3-dipropylpyrimidine-2,4-dione
IUPAC NAME: 5-amino-6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1,3-dipropylpyrimidine-2,4-dione
SYSTEMATIC NAME: 5-azanyl-6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1,3-dipropyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C19H22ClN3O3
MOLECULAR WEIGHT: 375.84928
SMILES: CCCN1C(=C(C(=O)N(C1=O)CCC)N)C(=O)/C=C/C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-[(E)-2-(4-methoxyphenyl)vinyl]-7-methyl-3H-purine-2,6-dione
CAS Name: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione
IUPAC NAME: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione
SYSTEMATIC NAME: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione
MOLECULAR FORMULA: C15H14N4O3
MOLECULAR WEIGHT: 298.29666
SMILES: CN1C=NC2=C1C(=O)N(C(=O)N2)/C=C/C3=CC=C(C=C3)OC
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Product OPENEYE NAME: 5-amino-6-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-1,3-dipropyl-pyrimidine-2,4-dione
CAS Name: 5-amino-6-[(E)-3-(3,4-dichlorophenyl)-1-oxoprop-2-enyl]-1,3-dipropylpyrimidine-2,4-dione
IUPAC NAME: 5-amino-6-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-1,3-dipropylpyrimidine-2,4-dione
SYSTEMATIC NAME: 5-azanyl-6-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-1,3-dipropyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C19H21Cl2N3O3
MOLECULAR WEIGHT: 410.29434
SMILES: CCCN1C(=C(C(=O)N(C1=O)CCC)N)C(=O)/C=C/C2=CC(=C(C=C2)Cl)Cl
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Product OPENEYE NAME: 8-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]-3,7-dihydropurine-2,6-dione
CAS Name: 8-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-3,7-dihydropurine-2,6-dione
IUPAC NAME: 8-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-3,7-dihydropurine-2,6-dione
SYSTEMATIC NAME: 8-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-3,7-dihydropurine-2,6-dione
MOLECULAR FORMULA: C16H16N4O5
MOLECULAR WEIGHT: 344.32204
SMILES: COC1=CC(=CC(=C1OC)OC)/C=C/C2=NC3=C(N2)C(=O)NC(=O)N3
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Product OPENEYE NAME: 8-[(E)-2-(4-methoxyphenyl)vinyl]-3,7-dihydropurine-2,6-dione
CAS Name: 8-[(E)-2-(4-methoxyphenyl)ethenyl]-3,7-dihydropurine-2,6-dione
IUPAC NAME: 8-[(E)-2-(4-methoxyphenyl)ethenyl]-3,7-dihydropurine-2,6-dione
SYSTEMATIC NAME: 8-[(E)-2-(4-methoxyphenyl)ethenyl]-3,7-dihydropurine-2,6-dione
MOLECULAR FORMULA: C14H12N4O3
MOLECULAR WEIGHT: 284.27008
SMILES: COC1=CC=C(C=C1)/C=C/C2=NC3=C(N2)C(=O)NC(=O)N3
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Product OPENEYE NAME: tert-butyl-[3-(tetradecanoylamino)propyl]ammonium bromide
CAS Name: tert-butyl-[3-(1-oxotetradecylamino)propyl]ammonium bromide
IUPAC NAME: tert-butyl-[3-(tetradecanoylamino)propyl]azanium bromide
SYSTEMATIC NAME: tert-butyl-[3-(tetradecanoylamino)propyl]azanium bromide
MOLECULAR FORMULA: C21H45BrN2O
MOLECULAR WEIGHT: 421.4988
SMILES: CCCCCCCCCCCCCC(=O)NCCC[NH2+]C(C)(C)C.[Br-]
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Product OPENEYE NAME: N-[3-(tert-butylamino)propyl]tetradecanamide
CAS Name: N-[3-(tert-butylamino)propyl]tetradecanamide
IUPAC NAME: N-[3-(tert-butylamino)propyl]tetradecanamide
SYSTEMATIC NAME: N-[3-(tert-butylamino)propyl]tetradecanamide
MOLECULAR FORMULA: C21H44N2O
MOLECULAR WEIGHT: 340.58686
SMILES: CCCCCCCCCCCCCC(=O)NCCCNC(C)(C)C
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Product OPENEYE NAME: 3-(docosanoylamino)propyl-trimethyl-ammonium iodide
CAS Name: trimethyl-[3-(1-oxodocosylamino)propyl]ammonium iodide
IUPAC NAME: 3-(docosanoylamino)propyl-trimethylazanium iodide
SYSTEMATIC NAME: 3-(docosanoylamino)propyl-trimethyl-azanium iodide
MOLECULAR FORMULA: C28H59IN2O
MOLECULAR WEIGHT: 566.68533
SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)C.[I-]
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Product OPENEYE NAME: 2-(hexadecanoylamino)ethyl-trimethyl-ammonium; 4-methylbenzenesulfonate
CAS Name: 4-methylbenzenesulfonate; trimethyl-[2-(1-oxohexadecylamino)ethyl]ammonium
IUPAC NAME: 2-(hexadecanoylamino)ethyl-trimethylazanium; 4-methylbenzenesulfonate
SYSTEMATIC NAME: 2-(hexadecanoylamino)ethyl-trimethyl-azanium; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C28H52N2O4S
MOLECULAR WEIGHT: 512.78848
SMILES: CCCCCCCCCCCCCCCC(=O)NCC[N+](C)(C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]
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Product OPENEYE NAME: trimethyl-[1-(tricosanoylamino)propyl]ammonium iodide
CAS Name: trimethyl-[1-(1-oxotricosylamino)propyl]ammonium iodide
IUPAC NAME: trimethyl-[1-(tricosanoylamino)propyl]azanium iodide
SYSTEMATIC NAME: trimethyl-[1-(tricosanoylamino)propyl]azanium iodide
MOLECULAR FORMULA: C29H61IN2O
MOLECULAR WEIGHT: 580.71191
SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC)[N+](C)(C)C.[I-]
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Product OPENEYE NAME: trimethyl-[1-(tricosanoylamino)propyl]ammonium
CAS Name: trimethyl-[1-(1-oxotricosylamino)propyl]ammonium
IUPAC NAME: trimethyl-[1-(tricosanoylamino)propyl]azanium
SYSTEMATIC NAME: trimethyl-[1-(tricosanoylamino)propyl]azanium
MOLECULAR FORMULA: C29H61N2O+
MOLECULAR WEIGHT: 453.80744
SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC)[N+](C)(C)C
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Product OPENEYE NAME: (5-chlorothiadiazol-4-yl)methyl 2-[(4-methylphenoxy)methyl]thiazole-4-carboxylate
CAS Name: 2-[(4-methylphenoxy)methyl]-4-thiazolecarboxylic acid (5-chloro-4-thiadiazolyl)methyl ester
IUPAC NAME: (5-chlorothiadiazol-4-yl)methyl 2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C15H12ClN3O3S2
MOLECULAR WEIGHT: 381.85708
SMILES: CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)OCC3=C(SN=N3)Cl
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Product OPENEYE NAME: [2-(2,5-difluoroanilino)-2-oxo-ethyl] 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propanoate
CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)propanoic acid [2-(2,5-difluoroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2,5-difluoroanilino)-2-oxoethyl] 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)propanoate
SYSTEMATIC NAME: [2-[[2,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propanoate
MOLECULAR FORMULA: C18H17F2N5O5
MOLECULAR WEIGHT: 421.354886
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)OCC(=O)NC3=C(C=CC(=C3)F)F
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