phenacyl 4-[[5-[2-(3-methoxyphenyl)-2-oxidanylidene-ethoxy]-5-oxidanylidene-pentanoyl]amino]benzoate

Systemtic Name: phenacyl 4-[[5-[2-(3-methoxyphenyl)-2-oxidanylidene-ethoxy]-5-oxidanylidene-pentanoyl]amino]benzoate Openeye Name: phenacyl 4-[[5-[2-(3-methoxyphenyl)-2-oxo-ethoxy]-5-oxo-pentanoyl]amino]benzoate CAS Name: 4-[[5-[2-(3-methoxyphenyl)-2-oxoethoxy]-1,5-dioxopentyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[5-[2-(3-methoxyphenyl)-2-oxoethoxy]-5-oxopentanoyl]amino]benzoate Traditional Name: 4-[[5-keto-5-[2-keto-2-(3-methoxyphenyl)ethoxy]pentanoyl]amino]benzoic acid phenacyl ester Formula: C29H27NO8 MolecularWeight: 517.52658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H27NO8/c1-36-24-10-5-9-22(17-24)26(32)18-37-28(34)12-6-11-27(33)30-23-15-13-21(14-16-23)29(35)38-19-25(31)20-7-3-2-4-8-20/h2-5,7-10,13-17H,6,11-12,18-19H2,1H3,(H,30,33)