3-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-2-methyl-benzoic acid

Systemtic Name: 3-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-2-methyl-benzoic acid Openeye Name: 3-[(3-hydroxy-4-methoxy-phenyl)methylamino]-2-methyl-benzoic acid CAS Name: 3-[(3-hydroxy-4-methoxyphenyl)methylamino]-2-methylbenzoic acid IUPAC Name: 3-[(3-hydroxy-4-methoxyphenyl)methylamino]-2-methylbenzoic acid Traditional Name: 3-[(3-hydroxy-4-methoxy-benzyl)amino]-2-methyl-benzoic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=CC(=C(C=C2)OC)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NCC2=CC(=C(C=C2)OC)O)C(=O)O

InChI

InChI=1S/C16H17NO4/c1-10-12(16(19)20)4-3-5-13(10)17-9-11-6-7-15(21-2)14(18)8-11/h3-8,17-18H,9H2,1-2H3,(H,19,20)