methyl 1-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(4-chlorophenyl)sulfonyl-methylamino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]benzoyl]isonipecotic acid methyl ester Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O5S/c1-23(30(27,28)19-9-5-17(22)6-10-19)18-7-3-15(4-8-18)20(25)24-13-11-16(12-14-24)21(26)29-2/h3-10,16H,11-14H2,1-2H3