1-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(3,4-dimethylanilino)-2-oxo-ethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[2-(3,4-dimethylanilino)-2-oxoethyl]-N-(4-phenoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,4-dimethylanilino)-2-oxoethyl]-N-(4-phenoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(3,4-dimethylanilino)-2-keto-ethyl]-N-(4-phenoxyphenyl)isonipecotamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O3/c1-20-8-9-24(18-21(20)2)29-27(32)19-31-16-14-22(15-17-31)28(33)30-23-10-12-26(13-11-23)34-25-6-4-3-5-7-25/h3-13,18,22H,14-17,19H2,1-2H3,(H,29,32)(H,30,33)