4-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-hydroxy-4-methoxy-phenyl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(3-hydroxy-4-methoxyphenyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(3-hydroxy-4-methoxyphenyl)methylamino]-4-oxobutanoic acid Traditional Name: 4-[(3-hydroxy-4-methoxy-benzyl)amino]-4-keto-butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCC(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCC(=O)O)O

InChI

InChI=1S/C12H15NO5/c1-18-10-3-2-8(6-9(10)14)7-13-11(15)4-5-12(16)17/h2-3,6,14H,4-5,7H2,1H3,(H,13,15)(H,16,17)