1-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(4-methylanilino)-2-oxo-ethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[2-(4-methylanilino)-2-oxoethyl]-N-(4-phenoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-methylanilino)-2-oxoethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-keto-2-(p-toluidino)ethyl]-N-(4-phenoxyphenyl)isonipecotamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O3/c1-20-7-9-22(10-8-20)28-26(31)19-30-17-15-21(16-18-30)27(32)29-23-11-13-25(14-12-23)33-24-5-3-2-4-6-24/h2-14,21H,15-19H2,1H3,(H,28,31)(H,29,32)