methyl 1-[2-[(4-methoxyphenyl)sulfonyl-phenyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(4-methoxyphenyl)sulfonyl-phenyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(N-(4-methoxyphenyl)sulfonylanilino)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]isonipecotic acid methyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O6S/c1-29-19-8-10-20(11-9-19)31(27,28)24(18-6-4-3-5-7-18)16-21(25)23-14-12-17(13-15-23)22(26)30-2/h3-11,17H,12-16H2,1-2H3