N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[cyclopropyl-(4-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[cyclopropyl-(4-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[cyclopropyl-(4-methoxyphenyl)methyl]isonipecotamide Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O4S/c1-29-20-11-9-18(10-12-20)22(17-7-8-17)24-23(26)19-13-15-25(16-14-19)30(27,28)21-5-3-2-4-6-21/h2-6,9-12,17,19,22H,7-8,13-16H2,1H3,(H,24,26)