methyl 1-[2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[benzyl-(4-methoxyphenyl)sulfonylamino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]benzoyl]isonipecotic acid methyl ester Formula: C28H30N2O6S MolecularWeight: 522.6126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)N4CCC(CC4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)N4CCC(CC4)C(=O)OC

InChI

InChI=1S/C28H30N2O6S/c1-35-23-12-14-24(15-13-23)37(33,34)30(20-21-8-4-3-5-9-21)26-11-7-6-10-25(26)27(31)29-18-16-22(17-19-29)28(32)36-2/h3-15,22H,16-20H2,1-2H3