2-methyl-3-[(2,4,5-trimethylphenyl)methylamino]benzoic acid

Systemtic Name: 2-methyl-3-[(2,4,5-trimethylphenyl)methylamino]benzoic acid Openeye Name: 2-methyl-3-[(2,4,5-trimethylphenyl)methylamino]benzoic acid CAS Name: 2-methyl-3-[(2,4,5-trimethylphenyl)methylamino]benzoic acid IUPAC Name: 2-methyl-3-[(2,4,5-trimethylphenyl)methylamino]benzoic acid Traditional Name: 2-methyl-3-[(2,4,5-trimethylbenzyl)amino]benzoic acid Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)CNC2=CC=CC(=C2C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)CNC2=CC=CC(=C2C)C(=O)O)C

InChI

InChI=1S/C18H21NO2/c1-11-8-13(3)15(9-12(11)2)10-19-17-7-5-6-16(14(17)4)18(20)21/h5-9,19H,10H2,1-4H3,(H,20,21)