3-(5-methylhexan-2-ylamino)benzoic acid

Systemtic Name: 3-(5-methylhexan-2-ylamino)benzoic acid Openeye Name: 3-(1,4-dimethylpentylamino)benzoic acid CAS Name: 3-(5-methylhexan-2-ylamino)benzoic acid IUPAC Name: 3-(5-methylhexan-2-ylamino)benzoic acid Traditional Name: 3-(1,4-dimethylpentylamino)benzoic acid Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CC(C)CCC(C)NC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C14H21NO2/c1-10(2)7-8-11(3)15-13-6-4-5-12(9-13)14(16)17/h4-6,9-11,15H,7-8H2,1-3H3,(H,16,17)