3-cyanopropyl 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 3-cyanopropyl 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 3-cyanopropyl 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-4-piperidinecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylisonipecotic acid 3-cyanopropyl ester Formula: C16H19ClN2O4S MolecularWeight: 370.85106

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCCC#N)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CN(CCC1C(=O)OCCCC#N)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H19ClN2O4S/c17-14-3-5-15(6-4-14)24(21,22)19-10-7-13(8-11-19)16(20)23-12-2-1-9-18/h3-6,13H,1-2,7-8,10-12H2