methyl 1-[2-[(3-chlorophenyl)-(4-methoxyphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(3-chlorophenyl)-(4-methoxyphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-chloro-N-(4-methoxyphenyl)sulfonyl-anilino)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(3-chloro-N-(4-methoxyphenyl)sulfonylanilino)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-chloro-N-(4-methoxyphenyl)sulfonylanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-chloro-N-(4-methoxyphenyl)sulfonyl-anilino)acetyl]isonipecotic acid methyl ester Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN2O6S/c1-30-19-6-8-20(9-7-19)32(28,29)25(18-5-3-4-17(23)14-18)15-21(26)24-12-10-16(11-13-24)22(27)31-2/h3-9,14,16H,10-13,15H2,1-2H3