[6,7-dimethoxy-1-[(4-methylphenyl)methyl]-2-oxidanylidene-quinolin-3-yl]methyl-(phenylmethyl)azanium

Systemtic Name: [6,7-dimethoxy-1-[(4-methylphenyl)methyl]-2-oxidanylidene-quinolin-3-yl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[6,7-dimethoxy-2-oxo-1-(p-tolylmethyl)-3-quinolyl]methyl]ammonium CAS Name: [6,7-dimethoxy-1-[(4-methylphenyl)methyl]-2-oxo-3-quinolinyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[6,7-dimethoxy-1-[(4-methylphenyl)methyl]-2-oxoquinolin-3-yl]methyl]azanium Traditional Name: benzyl-[[2-keto-6,7-dimethoxy-1-(4-methylbenzyl)-3-quinolyl]methyl]ammonium Formula: C27H29N2O3+ MolecularWeight: 429.53076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=CC(=C(C=C3C=C(C2=O)C[NH2+]CC4=CC=CC=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=CC(=C(C=C3C=C(C2=O)C[NH2+]CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C27H28N2O3/c1-19-9-11-21(12-10-19)18-29-24-15-26(32-3)25(31-2)14-22(24)13-23(27(29)30)17-28-16-20-7-5-4-6-8-20/h4-15,28H,16-18H2,1-3H3/p+1