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

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-[[5-oxidanylidene-5-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)pentanoyl]amino]benzoate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 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 [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 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 [2-keto-2-(p-tolyl)ethyl] ester Formula: C27H25NO7S MolecularWeight: 507.5549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

CC1=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/C27H25NO7S/c1-18-7-9-19(10-8-18)22(29)16-35-27(33)20-11-13-21(14-12-20)28-25(31)5-2-6-26(32)34-17-23(30)24-4-3-15-36-24/h3-4,7-15H,2,5-6,16-17H2,1H3,(H,28,31)