3-(2-ethylbutylamino)-2-methyl-benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC1=CC=CC(=C1C)C(=O)O

Isomeric SMILES

CCC(CC)CNC1=CC=CC(=C1C)C(=O)O

InChI

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