2,7,8-trimethyl-3-[[methyl-(phenylmethyl)azaniumyl]methyl]quinolin-4-olate

Systemtic Name: 2,7,8-trimethyl-3-[[methyl-(phenylmethyl)azaniumyl]methyl]quinolin-4-olate Openeye Name: 3-[[benzyl(methyl)ammonio]methyl]-2,7,8-trimethyl-quinolin-4-olate CAS Name: 2,7,8-trimethyl-3-[[methyl-(phenylmethyl)ammonio]methyl]-4-quinolinolate IUPAC Name: 3-[[benzyl(methyl)azaniumyl]methyl]-2,7,8-trimethylquinolin-4-olate Traditional Name: 3-[[benzyl(methyl)ammonio]methyl]-2,7,8-trimethyl-quinolin-4-olate Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=C(C(=N2)C)C[NH+](C)CC3=CC=CC=C3)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=C(C(=N2)C)C[NH+](C)CC3=CC=CC=C3)[O-])C

InChI

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