(6-ethyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)azanium

Systemtic Name: (6-ethyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(6-ethyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-methyl-ammonium CAS Name: (6-ethyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(6-ethyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-methylazanium Traditional Name: benzyl-[(6-ethyl-4-keto-2-methyl-1H-quinolin-3-yl)methyl]-methyl-ammonium Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

InChI

InChI=1S/C21H24N2O/c1-4-16-10-11-20-18(12-16)21(24)19(15(2)22-20)14-23(3)13-17-8-6-5-7-9-17/h5-12H,4,13-14H2,1-3H3,(H,22,24)/p+1