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

Systemtic Name: 3-methyl-4-[(2,4,5-trimethylphenyl)methylamino]benzoic acid Openeye Name: 3-methyl-4-[(2,4,5-trimethylphenyl)methylamino]benzoic acid CAS Name: 3-methyl-4-[(2,4,5-trimethylphenyl)methylamino]benzoic acid IUPAC Name: 3-methyl-4-[(2,4,5-trimethylphenyl)methylamino]benzoic acid Traditional Name: 3-methyl-4-[(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=C(C=C(C=C2)C(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C)CNC2=C(C=C(C=C2)C(=O)O)C)C

InChI

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