N-(2-ethylphenyl)-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-ethylphenyl)-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-benzylsulfonyl-N-(2-ethylphenyl)piperidine-4-carboxamide CAS Name: N-(2-ethylphenyl)-1-(phenylmethyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-benzylsulfonyl-N-(2-ethylphenyl)piperidine-4-carboxamide Traditional Name: 1-benzylsulfonyl-N-(2-ethylphenyl)isonipecotamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S/c1-2-18-10-6-7-11-20(18)22-21(24)19-12-14-23(15-13-19)27(25,26)16-17-8-4-3-5-9-17/h3-11,19H,2,12-16H2,1H3,(H,22,24)