ethyl (3S)-1-[4-chloranyl-3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[4-chloranyl-3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[4-chloro-3-[(2-methoxyphenyl)sulfamoyl]benzoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[4-chloro-3-[(2-methoxyphenyl)sulfamoyl]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[4-chloro-3-[(2-methoxyphenyl)sulfamoyl]benzoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[4-chloro-3-[(2-methoxyphenyl)sulfamoyl]benzoyl]nipecotic acid ethyl ester Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H25ClN2O6S/c1-3-31-22(27)16-7-6-12-25(14-16)21(26)15-10-11-17(23)20(13-15)32(28,29)24-18-8-4-5-9-19(18)30-2/h4-5,8-11,13,16,24H,3,6-7,12,14H2,1-2H3/t16-/m0/s1