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

Systemtic Name: (6-butyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(6-butyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-methyl-ammonium CAS Name: (6-butyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(6-butyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-methylazanium Traditional Name: benzyl-[(6-butyl-4-keto-2-methyl-1H-quinolin-3-yl)methyl]-methyl-ammonium Formula: C23H29N2O+ MolecularWeight: 349.48916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H28N2O/c1-4-5-9-18-12-13-22-20(14-18)23(26)21(17(2)24-22)16-25(3)15-19-10-7-6-8-11-19/h6-8,10-14H,4-5,9,15-16H2,1-3H3,(H,24,26)/p+1