[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(4-methylphenyl)carbonylbenzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC=CC=C1C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC=CC=C1C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H25NO4/c1-4-17(5-2)23-20(24)14-27-22(26)19-9-7-6-8-18(19)21(25)16-12-10-15(3)11-13-16/h6-13,17H,4-5,14H2,1-3H3,(H,23,24)