phenacyl 4-[[5-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)pentanoyl]amino]benzoate

Systemtic Name: phenacyl 4-[[5-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)pentanoyl]amino]benzoate Openeye Name: phenacyl 4-[[5-oxo-5-[2-oxo-2-(2-thienyl)ethoxy]pentanoyl]amino]benzoate CAS Name: 4-[[1,5-dioxo-5-(2-oxo-2-thiophen-2-ylethoxy)pentyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[5-oxo-5-(2-oxo-2-thiophen-2-ylethoxy)pentanoyl]amino]benzoate Traditional Name: 4-[[5-keto-5-[2-keto-2-(2-thienyl)ethoxy]pentanoyl]amino]benzoic acid phenacyl ester Formula: C26H23NO7S MolecularWeight: 493.52832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C26H23NO7S/c28-21(18-6-2-1-3-7-18)16-34-26(32)19-11-13-20(14-12-19)27-24(30)9-4-10-25(31)33-17-22(29)23-8-5-15-35-23/h1-3,5-8,11-15H,4,9-10,16-17H2,(H,27,30)