(E)-4-oxidanylidene-4-[(4-propoxyphenyl)amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[(4-propoxyphenyl)amino]but-2-enoic acid Openeye Name: (E)-4-oxo-4-(4-propoxyanilino)but-2-enoic acid CAS Name: (E)-4-oxo-4-(4-propoxyanilino)-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(4-propoxyanilino)but-2-enoic acid Traditional Name: (E)-4-keto-4-(4-propoxyanilino)but-2-enoic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H15NO4/c1-2-9-18-11-5-3-10(4-6-11)14-12(15)7-8-13(16)17/h3-8H,2,9H2,1H3,(H,14,15)(H,16,17)/b8-7+