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

Systemtic Name: 4-[(2-methyl-1-oxidanidyl-quinolin-1-ium-4-yl)methoxy]benzoic acid Openeye Name: 4-[(2-methyl-1-oxido-quinolin-1-ium-4-yl)methoxy]benzoic acid CAS Name: 4-[(2-methyl-1-oxido-4-quinolin-1-iumyl)methoxy]benzoic acid IUPAC Name: 4-[(2-methyl-1-oxidoquinolin-1-ium-4-yl)methoxy]benzoic acid Traditional Name: 4-[(2-methyl-1-oxido-quinolin-1-ium-4-yl)methoxy]benzoic acid Formula: C18H15NO4 MolecularWeight: 309.316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)C(=O)O)[O-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)C(=O)O)[O-]

InChI

InChI=1S/C18H15NO4/c1-12-10-14(16-4-2-3-5-17(16)19(12)22)11-23-15-8-6-13(7-9-15)18(20)21/h2-10H,11H2,1H3,(H,20,21)