methyl 4-[[(4-chlorophenyl)sulfonyl-(1-cyclopropylcarbonylpiperidin-3-yl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(4-chlorophenyl)sulfonyl-(1-cyclopropylcarbonylpiperidin-3-yl)amino]methyl]benzoate Openeye Name: methyl 4-[[(4-chlorophenyl)sulfonyl-[1-(cyclopropanecarbonyl)-3-piperidyl]amino]methyl]benzoate CAS Name: 4-[[(4-chlorophenyl)sulfonyl-[1-[cyclopropyl(oxo)methyl]-3-piperidinyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4-chlorophenyl)sulfonyl-[1-(cyclopropanecarbonyl)piperidin-3-yl]amino]methyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)sulfonyl-[1-(cyclopropanecarbonyl)-3-piperidyl]amino]methyl]benzoic acid methyl ester Formula: C24H27ClN2O5S MolecularWeight: 490.99958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(C2CCCN(C2)C(=O)C3CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(C2CCCN(C2)C(=O)C3CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H27ClN2O5S/c1-32-24(29)19-6-4-17(5-7-19)15-27(33(30,31)22-12-10-20(25)11-13-22)21-3-2-14-26(16-21)23(28)18-8-9-18/h4-7,10-13,18,21H,2-3,8-9,14-16H2,1H3