2-chloranyl-5-(3-methylbutylamino)benzoic acid

Systemtic Name: 2-chloranyl-5-(3-methylbutylamino)benzoic acid Openeye Name: 2-chloro-5-(isopentylamino)benzoic acid CAS Name: 2-chloro-5-(3-methylbutylamino)benzoic acid IUPAC Name: 2-chloro-5-(3-methylbutylamino)benzoic acid Traditional Name: 2-chloro-5-(isoamylamino)benzoic acid Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO2/c1-8(2)5-6-14-9-3-4-11(13)10(7-9)12(15)16/h3-4,7-8,14H,5-6H2,1-2H3,(H,15,16)