ethyl 1-[3-[(4-bromophenyl)sulfonylamino]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(4-bromophenyl)sulfonylamino]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(4-bromophenyl)sulfonylamino]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[3-[(4-bromophenyl)sulfonylamino]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-bromophenyl)sulfonylamino]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[3-(brosylamino)benzoyl]nipecotic acid ethyl ester Formula: C21H23BrN2O5S MolecularWeight: 495.38672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O5S/c1-2-29-21(26)16-6-4-12-24(14-16)20(25)15-5-3-7-18(13-15)23-30(27,28)19-10-8-17(22)9-11-19/h3,5,7-11,13,16,23H,2,4,6,12,14H2,1H3