ethyl (3S)-1-[3-[(3-chlorophenyl)-methyl-sulfamoyl]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[3-[(3-chlorophenyl)-methyl-sulfamoyl]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[3-[(3-chlorophenyl)-methylsulfamoyl]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[3-[(3-chlorophenyl)-methylsulfamoyl]benzoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoyl]nipecotic acid ethyl ester Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H25ClN2O5S/c1-3-30-22(27)17-8-6-12-25(15-17)21(26)16-7-4-11-20(13-16)31(28,29)24(2)19-10-5-9-18(23)14-19/h4-5,7,9-11,13-14,17H,3,6,8,12,15H2,1-2H3/t17-/m0/s1