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

Systemtic Name: (6-butyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(6-butyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-ethyl-ammonium CAS Name: (6-butyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(6-butyl-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]-ethylazanium Traditional Name: benzyl-[(6-butyl-4-keto-2-methyl-1H-quinolin-3-yl)methyl]-ethyl-ammonium Formula: C24H31N2O+ MolecularWeight: 363.51574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O/c1-4-6-10-19-13-14-23-21(15-19)24(27)22(18(3)25-23)17-26(5-2)16-20-11-8-7-9-12-20/h7-9,11-15H,4-6,10,16-17H2,1-3H3,(H,25,27)/p+1