(E)-4-oxidanylidene-4-[(2-oxidanyl-1-phenyl-ethyl)amino]but-2-enoate

Systemtic Name: (E)-4-oxidanylidene-4-[(2-oxidanyl-1-phenyl-ethyl)amino]but-2-enoate Openeye Name: (E)-4-[(2-hydroxy-1-phenyl-ethyl)amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[(2-hydroxy-1-phenylethyl)amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[(2-hydroxy-1-phenylethyl)amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(2-hydroxy-1-phenyl-ethyl)amino]-4-keto-but-2-enoate Formula: C12H12NO4- MolecularWeight: 234.22798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(CO)NC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C12H13NO4/c14-8-10(9-4-2-1-3-5-9)13-11(15)6-7-12(16)17/h1-7,10,14H,8H2,(H,13,15)(H,16,17)/p-1/b7-6+