(E)-4-[[3-(1-hydroxyethyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-(1-hydroxyethyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(1-hydroxyethyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-(1-hydroxyethyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(1-hydroxyethyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3-(1-hydroxyethyl)anilino]-4-keto-but-2-enoic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-8(14)9-3-2-4-10(7-9)13-11(15)5-6-12(16)17/h2-8,14H,1H3,(H,13,15)(H,16,17)/b6-5+