4-(pentan-2-ylamino)benzoic acid

Systemtic Name: 4-(pentan-2-ylamino)benzoic acid Openeye Name: 4-(1-methylbutylamino)benzoic acid CAS Name: 4-(pentan-2-ylamino)benzoic acid IUPAC Name: 4-(pentan-2-ylamino)benzoic acid Traditional Name: 4-(1-methylbutylamino)benzoic acid Formula: C12H17NO2 MolecularWeight: 207.26888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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