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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4/c1-4-7-16(3)23-20(24)14-27-22(26)19-9-6-5-8-18(19)21(25)17-12-10-15(2)11-13-17/h5-6,8-13,16H,4,7,14H2,1-3H3,(H,23,24)