4-[[2,5-bis(ethoxycarbonyl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2,5-bis(ethoxycarbonyl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2,5-bis(ethoxycarbonyl)anilino]-4-oxo-butanoic acid CAS Name: 4-[2,5-bis(ethoxycarbonyl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[2,5-bis(ethoxycarbonyl)anilino]-4-oxobutanoic acid Traditional Name: 4-(2,5-dicarbethoxyanilino)-4-keto-butyric acid Formula: C16H19NO7 MolecularWeight: 337.32456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NC(=O)CCC(=O)O

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H19NO7/c1-3-23-15(21)10-5-6-11(16(22)24-4-2)12(9-10)17-13(18)7-8-14(19)20/h5-6,9H,3-4,7-8H2,1-2H3,(H,17,18)(H,19,20)