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

Systemtic Name: 3-(butan-2-ylamino)-4-methyl-benzoic acid Openeye Name: 4-methyl-3-(sec-butylamino)benzoic acid CAS Name: 3-(butan-2-ylamino)-4-methylbenzoic acid IUPAC Name: 3-(butan-2-ylamino)-4-methylbenzoic acid Traditional Name: 4-methyl-3-(sec-butylamino)benzoic acid Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-4-9(3)13-11-7-10(12(14)15)6-5-8(11)2/h5-7,9,13H,4H2,1-3H3,(H,14,15)