3-methyl-4-(2-methylpentylamino)benzoic acid

Systemtic Name: 3-methyl-4-(2-methylpentylamino)benzoic acid Openeye Name: 3-methyl-4-(2-methylpentylamino)benzoic acid CAS Name: 3-methyl-4-(2-methylpentylamino)benzoic acid IUPAC Name: 3-methyl-4-(2-methylpentylamino)benzoic acid Traditional Name: 3-methyl-4-(2-methylpentylamino)benzoic acid Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CNC1=C(C=C(C=C1)C(=O)O)C

Isomeric SMILES

CCCC(C)CNC1=C(C=C(C=C1)C(=O)O)C

InChI

InChI=1S/C14H21NO2/c1-4-5-10(2)9-15-13-7-6-12(14(16)17)8-11(13)3/h6-8,10,15H,4-5,9H2,1-3H3,(H,16,17)