2-[(6-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid

Systemtic Name: 2-[(6-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid Openeye Name: 2-[(6-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid CAS Name: 2-[(6-methoxy-2-methyl-4-quinolin-1-iumyl)amino]benzoic acid IUPAC Name: 2-[(6-methoxy-2-methylquinolin-1-ium-4-yl)amino]benzoic acid Traditional Name: 2-[(6-methoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid Formula: C18H17N2O3+ MolecularWeight: 309.33918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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