4-[[4-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]carbonylphenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]carbonylphenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethoxy]carbonylanilino]-4-oxo-butanoic acid CAS Name: 4-[4-[[2-(2-ethyl-6-methylanilino)-2-oxoethoxy]-oxomethyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[2-(2-ethyl-6-methylanilino)-2-oxoethoxy]carbonylanilino]-4-oxobutanoic acid Traditional Name: 4-[4-[2-(2-ethyl-6-methyl-anilino)-2-keto-ethoxy]carbonylanilino]-4-keto-butyric acid Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O)C

InChI

InChI=1S/C22H24N2O6/c1-3-15-6-4-5-14(2)21(15)24-19(26)13-30-22(29)16-7-9-17(10-8-16)23-18(25)11-12-20(27)28/h4-10H,3,11-13H2,1-2H3,(H,23,25)(H,24,26)(H,27,28)