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

Systemtic Name: 2-[1-(4-methyl-2-oxidanyl-phenyl)ethylamino]benzoic acid Openeye Name: 2-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]benzoic acid CAS Name: 2-[1-(2-hydroxy-4-methylphenyl)ethylamino]benzoic acid IUPAC Name: 2-[1-(2-hydroxy-4-methylphenyl)ethylamino]benzoic acid Traditional Name: 2-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]benzoic acid Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC2=CC=CC=C2C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC2=CC=CC=C2C(=O)O)O

InChI

InChI=1S/C16H17NO3/c1-10-7-8-12(15(18)9-10)11(2)17-14-6-4-3-5-13(14)16(19)20/h3-9,11,17-18H,1-2H3,(H,19,20)