1-[(3-methylphenyl)methylsulfonyl]-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-methylphenyl)methylsulfonyl]-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide Openeye Name: N-(4-benzyloxyphenyl)-1-(m-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-N-(4-phenylmethoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(3-methylphenyl)methylsulfonyl]-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide Traditional Name: N-(4-benzoxyphenyl)-1-(3-methylbenzyl)sulfonyl-isonipecotamide Formula: C27H30N2O4S MolecularWeight: 478.6031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O4S/c1-21-6-5-9-23(18-21)20-34(31,32)29-16-14-24(15-17-29)27(30)28-25-10-12-26(13-11-25)33-19-22-7-3-2-4-8-22/h2-13,18,24H,14-17,19-20H2,1H3,(H,28,30)