1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(3-methylbutyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(3-methylbutyl)piperidine-4-carboxamide Openeye Name: 1-[2-(3,5-dimethylanilino)-2-oxo-ethyl]-N-isopentyl-piperidine-4-carboxamide CAS Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(3-methylbutyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(3-methylbutyl)piperidine-4-carboxamide Traditional Name: 1-[2-(3,5-dimethylanilino)-2-keto-ethyl]-N-isoamyl-isonipecotamide Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)NCCC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)NCCC(C)C)C

InChI

InChI=1S/C21H33N3O2/c1-15(2)5-8-22-21(26)18-6-9-24(10-7-18)14-20(25)23-19-12-16(3)11-17(4)13-19/h11-13,15,18H,5-10,14H2,1-4H3,(H,22,26)(H,23,25)