4-[1-(methoxymethyl)-4-oxidanylidene-quinolin-1-ium-1-yl]-3-methyl-butanamide

Systemtic Name: 4-[1-(methoxymethyl)-4-oxidanylidene-quinolin-1-ium-1-yl]-3-methyl-butanamide Openeye Name: 4-[1-(methoxymethyl)-4-oxo-quinolin-1-ium-1-yl]-3-methyl-butanamide CAS Name: 4-[1-(methoxymethyl)-4-oxo-1-quinolin-1-iumyl]-3-methylbutanamide IUPAC Name: 4-[1-(methoxymethyl)-4-oxoquinolin-1-ium-1-yl]-3-methylbutanamide Traditional Name: 4-[4-keto-1-(methoxymethyl)quinolin-1-ium-1-yl]-3-methyl-butyramide Formula: C16H21N2O3+ MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N)C[N+]1(C=CC(=O)C2=CC=CC=C21)COC

Isomeric SMILES

CC(CC(=O)N)C[N+]1(C=CC(=O)C2=CC=CC=C21)COC

InChI

InChI=1S/C16H20N2O3/c1-12(9-16(17)20)10-18(11-21-2)8-7-15(19)13-5-3-4-6-14(13)18/h3-8,12H,9-11H2,1-2H3,(H-,17,20)/p+1