2-methyl-6-propoxy-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one

Systemtic Name: 2-methyl-6-propoxy-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one Openeye Name: 2-methyl-6-propoxy-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one CAS Name: 2-methyl-6-propoxy-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one IUPAC Name: 2-methyl-6-propoxy-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one Traditional Name: 2-methyl-6-propoxy-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-4-quinolone Formula: C23H27N2O2+ MolecularWeight: 363.47268

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+]3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CCCOC1=CC2=C(C=C1)NC(=C(C2=O)C[NH+]3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C23H26N2O2/c1-3-12-27-19-8-9-22-20(13-19)23(26)21(16(2)24-22)15-25-11-10-17-6-4-5-7-18(17)14-25/h4-9,13H,3,10-12,14-15H2,1-2H3,(H,24,26)/p+1