ethyl 4-(quinolin-1-ium-4-ylamino)benzoate

Systemtic Name: ethyl 4-(quinolin-1-ium-4-ylamino)benzoate Openeye Name: ethyl 4-(quinolin-1-ium-4-ylamino)benzoate CAS Name: 4-(4-quinolin-1-iumylamino)benzoic acid ethyl ester IUPAC Name: ethyl 4-(quinolin-1-ium-4-ylamino)benzoate Traditional Name: 4-(quinolin-1-ium-4-ylamino)benzoic acid ethyl ester Formula: C18H17N2O2+ MolecularWeight: 293.33978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=CC=[NH+]C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=CC=[NH+]C3=CC=CC=C32

InChI

InChI=1S/C18H16N2O2/c1-2-22-18(21)13-7-9-14(10-8-13)20-17-11-12-19-16-6-4-3-5-15(16)17/h3-12H,2H2,1H3,(H,19,20)/p+1