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

Systemtic Name: 3-methyl-4-(pentan-2-ylamino)benzoic acid Openeye Name: 3-methyl-4-(1-methylbutylamino)benzoic acid CAS Name: 3-methyl-4-(pentan-2-ylamino)benzoic acid IUPAC Name: 3-methyl-4-(pentan-2-ylamino)benzoic acid Traditional Name: 3-methyl-4-(1-methylbutylamino)benzoic acid Formula: C13H19NO2 MolecularWeight: 221.29546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-4-5-10(3)14-12-7-6-11(13(15)16)8-9(12)2/h6-8,10,14H,4-5H2,1-3H3,(H,15,16)