3-methyl-4-(4-methylpentan-2-ylamino)benzoic acid

Systemtic Name: 3-methyl-4-(4-methylpentan-2-ylamino)benzoic acid Openeye Name: 4-(1,3-dimethylbutylamino)-3-methyl-benzoic acid CAS Name: 3-methyl-4-(4-methylpentan-2-ylamino)benzoic acid IUPAC Name: 3-methyl-4-(4-methylpentan-2-ylamino)benzoic acid Traditional Name: 4-(1,3-dimethylbutylamino)-3-methyl-benzoic acid Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(C)CC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(C)CC(C)C

InChI

InChI=1S/C14H21NO2/c1-9(2)7-11(4)15-13-6-5-12(14(16)17)8-10(13)3/h5-6,8-9,11,15H,7H2,1-4H3,(H,16,17)