3-(3-methylbutylamino)benzoic acid

Systemtic Name: 3-(3-methylbutylamino)benzoic acid Openeye Name: 3-(isopentylamino)benzoic acid CAS Name: 3-(3-methylbutylamino)benzoic acid IUPAC Name: 3-(3-methylbutylamino)benzoic acid Traditional Name: 3-(isoamylamino)benzoic acid Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CC(C)CCNC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C12H17NO2/c1-9(2)6-7-13-11-5-3-4-10(8-11)12(14)15/h3-5,8-9,13H,6-7H2,1-2H3,(H,14,15)