(E)-3-acetyloxy-5-oxidanylidene-5-phenylazanyl-pent-2-enoic acid

Systemtic Name: (E)-3-acetyloxy-5-oxidanylidene-5-phenylazanyl-pent-2-enoic acid Openeye Name: (E)-3-acetoxy-5-anilino-5-oxo-pent-2-enoic acid CAS Name: (E)-3-acetyloxy-5-anilino-5-oxo-2-pentenoic acid IUPAC Name: (E)-3-acetyloxy-5-anilino-5-oxopent-2-enoic acid Traditional Name: (E)-3-acetoxy-5-anilino-5-keto-pent-2-enoic acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(=CC(=O)O)CC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(=O)O/C(=C/C(=O)O)/CC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C13H13NO5/c1-9(15)19-11(8-13(17)18)7-12(16)14-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H,14,16)(H,17,18)/b11-8+