phenacyl 4-[[4-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethoxy]-4-oxidanylidene-butanoyl]amino]benzoate

Systemtic Name: phenacyl 4-[[4-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethoxy]-4-oxidanylidene-butanoyl]amino]benzoate Openeye Name: phenacyl 4-[[4-[2-(3,4-dimethylphenyl)-2-oxo-ethoxy]-4-oxo-butanoyl]amino]benzoate CAS Name: 4-[[4-[2-(3,4-dimethylphenyl)-2-oxoethoxy]-1,4-dioxobutyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[4-[2-(3,4-dimethylphenyl)-2-oxoethoxy]-4-oxobutanoyl]amino]benzoate Traditional Name: 4-[[4-[2-(3,4-dimethylphenyl)-2-keto-ethoxy]-4-keto-butanoyl]amino]benzoic acid phenacyl ester Formula: C29H27NO7 MolecularWeight: 501.52718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C29H27NO7/c1-19-8-9-23(16-20(19)2)26(32)17-36-28(34)15-14-27(33)30-24-12-10-22(11-13-24)29(35)37-18-25(31)21-6-4-3-5-7-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,30,33)