ethoxycarbonyloxymethyl 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate hydrochloride

Systemtic Name: ethoxycarbonyloxymethyl 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate hydrochloride Openeye Name: ethoxycarbonyloxymethyl 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylate hydrochloride CAS Name: 3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-4-piperidinyl)amino]-5-phenyl-2-thiophenecarboxylic acid ethoxycarbonyloxymethyl ester hydrochloride IUPAC Name: ethoxycarbonyloxymethyl 3-[(4-methylcyclohexanecarbonyl)-(1-methylpiperidin-4-yl)amino]-5-phenylthiophene-2-carboxylate hydrochloride Traditional Name: 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylic acid carbethoxyoxymethyl ester hydrochloride Formula: C29H39ClN2O6S MolecularWeight: 579.14776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)N(C3CCN(CC3)C)C(=O)C4CCC(CC4)C.Cl

Isomeric SMILES

CCOC(=O)OCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)N(C3CCN(CC3)C)C(=O)C4CCC(CC4)C.Cl

InChI

InChI=1S/C29H38N2O6S.ClH/c1-4-35-29(34)37-19-36-28(33)26-24(18-25(38-26)21-8-6-5-7-9-21)31(23-14-16-30(3)17-15-23)27(32)22-12-10-20(2)11-13-22;/h5-9,18,20,22-23H,4,10-17,19H2,1-3H3;1H