3-[1-(4-methoxy-2-oxidanyl-phenyl)ethylamino]benzoic acid

Systemtic Name: 3-[1-(4-methoxy-2-oxidanyl-phenyl)ethylamino]benzoic acid Openeye Name: 3-[1-(2-hydroxy-4-methoxy-phenyl)ethylamino]benzoic acid CAS Name: 3-[1-(2-hydroxy-4-methoxyphenyl)ethylamino]benzoic acid IUPAC Name: 3-[1-(2-hydroxy-4-methoxyphenyl)ethylamino]benzoic acid Traditional Name: 3-[1-(2-hydroxy-4-methoxy-phenyl)ethylamino]benzoic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)OC)O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C1=C(C=C(C=C1)OC)O)NC2=CC=CC(=C2)C(=O)O

InChI

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