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

Systemtic Name: (6-butoxy-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(6-butoxy-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-methyl-ammonium CAS Name: (6-butoxy-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(6-butoxy-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-methylazanium Traditional Name: benzyl-[(6-butoxy-4-keto-2-methyl-1H-quinolin-3-yl)methyl]-methyl-ammonium Formula: C23H29N2O2+ MolecularWeight: 365.48856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H28N2O2/c1-4-5-13-27-19-11-12-22-20(14-19)23(26)21(17(2)24-22)16-25(3)15-18-9-7-6-8-10-18/h6-12,14H,4-5,13,15-16H2,1-3H3,(H,24,26)/p+1