2-[(2-methylquinolin-1-ium-4-yl)amino]benzoic acid

Systemtic Name: 2-[(2-methylquinolin-1-ium-4-yl)amino]benzoic acid Openeye Name: 2-[(2-methylquinolin-1-ium-4-yl)amino]benzoic acid CAS Name: 2-[(2-methyl-4-quinolin-1-iumyl)amino]benzoic acid IUPAC Name: 2-[(2-methylquinolin-1-ium-4-yl)amino]benzoic acid Traditional Name: 2-[(2-methylquinolin-1-ium-4-yl)amino]benzoic acid Formula: C17H15N2O2+ MolecularWeight: 279.3132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=CC=CC=C2C(=C1)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=[NH+]C2=CC=CC=C2C(=C1)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H14N2O2/c1-11-10-16(12-6-2-4-8-14(12)18-11)19-15-9-5-3-7-13(15)17(20)21/h2-10H,1H3,(H,18,19)(H,20,21)/p+1