[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-[(5-oxidanylidene-5-phenacyloxy-pentanoyl)amino]benzoate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-[(5-oxidanylidene-5-phenacyloxy-pentanoyl)amino]benzoate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 4-[(5-oxo-5-phenacyloxy-pentanoyl)amino]benzoate CAS Name: 4-[(1,5-dioxo-5-phenacyloxypentyl)amino]benzoic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 4-[(5-oxo-5-phenacyloxypentanoyl)amino]benzoate Traditional Name: 4-[(5-keto-5-phenacyloxy-pentanoyl)amino]benzoic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C29H27NO7 MolecularWeight: 501.52718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H27NO7/c1-20-10-12-22(13-11-20)26(32)19-37-29(35)23-14-16-24(17-15-23)30-27(33)8-5-9-28(34)36-18-25(31)21-6-3-2-4-7-21/h2-4,6-7,10-17H,5,8-9,18-19H2,1H3,(H,30,33)