4-[[2-methoxy-4-[3-methoxy-4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-methoxy-4-[3-methoxy-4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[4-[(4-hydroxy-4-oxo-butanoyl)amino]-3-methoxy-phenyl]-2-methoxy-anilino]-4-oxo-butanoic acid CAS Name: 4-[4-[4-[(4-hydroxy-1,4-dioxobutyl)amino]-3-methoxyphenyl]-2-methoxyanilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[4-[(4-hydroxy-4-oxobutanoyl)amino]-3-methoxyphenyl]-2-methoxyanilino]-4-oxobutanoic acid Traditional Name: 4-[4-[4-[(4-hydroxy-4-keto-butanoyl)amino]-3-methoxy-phenyl]-2-methoxy-anilino]-4-keto-butyric acid Formula: C22H24N2O8 MolecularWeight: 444.43456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)CCC(=O)O)OC)NC(=O)CCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)CCC(=O)O)OC)NC(=O)CCC(=O)O

InChI

InChI=1S/C22H24N2O8/c1-31-17-11-13(3-5-15(17)23-19(25)7-9-21(27)28)14-4-6-16(18(12-14)32-2)24-20(26)8-10-22(29)30/h3-6,11-12H,7-10H2,1-2H3,(H,23,25)(H,24,26)(H,27,28)(H,29,30)