1-(3-chlorophenyl)sulfonyl-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)sulfonyl-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)sulfonyl-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)sulfonyl-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)sulfonyl-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)sulfonyl-4-phenyl-isonipecotic acid Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H18ClNO4S/c19-15-7-4-8-16(13-15)25(23,24)20-11-9-18(10-12-20,17(21)22)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,21,22)