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

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-[(4-oxidanylidene-4-phenacyloxy-butanoyl)amino]benzoate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 4-[(4-oxo-4-phenacyloxy-butanoyl)amino]benzoate CAS Name: 4-[(1,4-dioxo-4-phenacyloxybutyl)amino]benzoic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 4-[(4-oxo-4-phenacyloxybutanoyl)amino]benzoate Traditional Name: 4-[(4-keto-4-phenacyloxy-butanoyl)amino]benzoic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C28H25NO7 MolecularWeight: 487.5006

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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)CCC(=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)CCC(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H25NO7/c1-19-7-9-21(10-8-19)25(31)18-36-28(34)22-11-13-23(14-12-22)29-26(32)15-16-27(33)35-17-24(30)20-5-3-2-4-6-20/h2-14H,15-18H2,1H3,(H,29,32)