2-[(8-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid

Systemtic Name: 2-[(8-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid Openeye Name: 2-[(8-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid CAS Name: 2-[(8-methoxy-2-methyl-4-quinolin-1-iumyl)amino]benzoic acid IUPAC Name: 2-[(8-methoxy-2-methylquinolin-1-ium-4-yl)amino]benzoic acid Traditional Name: 2-[(8-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid Formula: C18H17N2O3+ MolecularWeight: 309.33918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=CC=C2OC)C(=C1)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=[NH+]C2=C(C=CC=C2OC)C(=C1)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H16N2O3/c1-11-10-15(12-7-5-9-16(23-2)17(12)19-11)20-14-8-4-3-6-13(14)18(21)22/h3-10H,1-2H3,(H,19,20)(H,21,22)/p+1