(E)-4-oxidanylidene-4-[(3-propan-2-yloxyphenyl)amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[(3-propan-2-yloxyphenyl)amino]but-2-enoic acid Openeye Name: (E)-4-(3-isopropoxyanilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-(3-propan-2-yloxyanilino)-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(3-propan-2-yloxyanilino)but-2-enoic acid Traditional Name: (E)-4-(3-isopropoxyanilino)-4-keto-but-2-enoic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)NC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H15NO4/c1-9(2)18-11-5-3-4-10(8-11)14-12(15)6-7-13(16)17/h3-9H,1-2H3,(H,14,15)(H,16,17)/b7-6+