(E)-2-azanyl-5-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: (E)-2-azanyl-5-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-2-amino-5-(4-hydroxy-3-methoxy-phenyl)-3-oxo-pent-4-enoic acid CAS Name: (E)-2-amino-5-(4-hydroxy-3-methoxyphenyl)-3-oxo-4-pentenoic acid IUPAC Name: (E)-2-amino-5-(4-hydroxy-3-methoxyphenyl)-3-oxopent-4-enoic acid Traditional Name: (E)-2-amino-5-(4-hydroxy-3-methoxy-phenyl)-3-keto-pent-4-enoic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C(C(=O)O)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C(C(=O)O)N)O

InChI

InChI=1S/C12H13NO5/c1-18-10-6-7(2-4-8(10)14)3-5-9(15)11(13)12(16)17/h2-6,11,14H,13H2,1H3,(H,16,17)/b5-3+