phenacyl 4-[[5-[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]oxy-5-oxidanylidene-pentanoyl]amino]benzoate

Systemtic Name: phenacyl 4-[[5-[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]oxy-5-oxidanylidene-pentanoyl]amino]benzoate Openeye Name: phenacyl 4-[[5-[2-(3-chlorophenyl)-1-methyl-2-oxo-ethoxy]-5-oxo-pentanoyl]amino]benzoate CAS Name: 4-[[5-[1-(3-chlorophenyl)-1-oxopropan-2-yl]oxy-1,5-dioxopentyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[5-[1-(3-chlorophenyl)-1-oxopropan-2-yl]oxy-5-oxopentanoyl]amino]benzoate Traditional Name: 4-[[5-[2-(3-chlorophenyl)-2-keto-1-methyl-ethoxy]-5-keto-pentanoyl]amino]benzoic acid phenacyl ester Formula: C29H26ClNO7 MolecularWeight: 535.97224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=CC=C1)Cl)OC(=O)CCCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CC(=CC=C1)Cl)OC(=O)CCCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H26ClNO7/c1-19(28(35)22-9-5-10-23(30)17-22)38-27(34)12-6-11-26(33)31-24-15-13-21(14-16-24)29(36)37-18-25(32)20-7-3-2-4-8-20/h2-5,7-10,13-17,19H,6,11-12,18H2,1H3,(H,31,33)