4-[(5-chloranyl-2-methoxy-phenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(5-chloro-2-methoxy-phenyl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(5-chloro-2-methoxyphenyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(5-chloro-2-methoxyphenyl)methylamino]-4-oxobutanoic acid Traditional Name: 4-[(5-chloro-2-methoxy-benzyl)amino]-4-keto-butyric acid Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClNO4/c1-18-10-3-2-9(13)6-8(10)7-14-11(15)4-5-12(16)17/h2-3,6H,4-5,7H2,1H3,(H,14,15)(H,16,17)