(E)-4-[[3,5-bis(ethoxycarbonyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3,5-bis(ethoxycarbonyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3,5-bis(ethoxycarbonyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3,5-bis(ethoxycarbonyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3,5-bis(ethoxycarbonyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-(3,5-dicarbethoxyanilino)-4-keto-but-2-enoic acid Formula: C16H17NO7 MolecularWeight: 335.30868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO7/c1-3-23-15(21)10-7-11(16(22)24-4-2)9-12(8-10)17-13(18)5-6-14(19)20/h5-9H,3-4H2,1-2H3,(H,17,18)(H,19,20)/b6-5+