methyl 4-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 4-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]piperidine-4-carboxylate Openeye Name: methyl 4-[benzyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-4-carboxylate CAS Name: 4-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[benzyl-(4-methoxyphenyl)sulfonylamino]piperidine-4-carboxylate Traditional Name: 4-[benzyl-(4-methoxyphenyl)sulfonyl-amino]isonipecotic acid methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3(CCNCC3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3(CCNCC3)C(=O)OC

InChI

InChI=1S/C21H26N2O5S/c1-27-18-8-10-19(11-9-18)29(25,26)23(16-17-6-4-3-5-7-17)21(20(24)28-2)12-14-22-15-13-21/h3-11,22H,12-16H2,1-2H3