phenacyl 4-[[4-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]oxy-4-oxidanylidene-butanoyl]amino]benzoate

Systemtic Name: phenacyl 4-[[4-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]oxy-4-oxidanylidene-butanoyl]amino]benzoate Openeye Name: phenacyl 4-[[4-[(1S)-1-methyl-2-oxo-2-(p-tolyl)ethoxy]-4-oxo-butanoyl]amino]benzoate CAS Name: 4-[[4-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxy-1,4-dioxobutyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[4-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxy-4-oxobutanoyl]amino]benzoate Traditional Name: 4-[[4-keto-4-[(1S)-2-keto-1-methyl-2-(p-tolyl)ethoxy]butanoyl]amino]benzoic acid phenacyl ester Formula: C29H27NO7 MolecularWeight: 501.52718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H27NO7/c1-19-8-10-22(11-9-19)28(34)20(2)37-27(33)17-16-26(32)30-24-14-12-23(13-15-24)29(35)36-18-25(31)21-6-4-3-5-7-21/h3-15,20H,16-18H2,1-2H3,(H,30,32)/t20-/m0/s1