methyl 1-[2-[(2,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(2,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[N-(benzenesulfonyl)-2,4-dimethoxy-anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-besyl-2,4-dimethoxy-anilino)acetyl]isonipecotic acid methyl ester Formula: C23H28N2O7S MolecularWeight: 476.54262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O7S/c1-30-18-9-10-20(21(15-18)31-2)25(33(28,29)19-7-5-4-6-8-19)16-22(26)24-13-11-17(12-14-24)23(27)32-3/h4-10,15,17H,11-14,16H2,1-3H3