2-chloranyl-5-[(3-methoxy-2-oxidanyl-phenyl)methylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[(3-methoxy-2-oxidanyl-phenyl)methylamino]benzoic acid Openeye Name: 2-chloro-5-[(2-hydroxy-3-methoxy-phenyl)methylamino]benzoic acid CAS Name: 2-chloro-5-[(2-hydroxy-3-methoxyphenyl)methylamino]benzoic acid IUPAC Name: 2-chloro-5-[(2-hydroxy-3-methoxyphenyl)methylamino]benzoic acid Traditional Name: 2-chloro-5-[(2-hydroxy-3-methoxy-benzyl)amino]benzoic acid Formula: C15H14ClNO4 MolecularWeight: 307.72896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)CNC2=CC(=C(C=C2)Cl)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1O)CNC2=CC(=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H14ClNO4/c1-21-13-4-2-3-9(14(13)18)8-17-10-5-6-12(16)11(7-10)15(19)20/h2-7,17-18H,8H2,1H3,(H,19,20)