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

Systemtic Name: 6-bromanyl-2-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one Openeye Name: 6-bromo-2-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one CAS Name: 6-bromo-2-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one IUPAC Name: 6-bromo-2-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one Traditional Name: 6-bromo-2-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-4-quinolone Formula: C20H20BrN2O+ MolecularWeight: 384.2896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)Br)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)Br)C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H19BrN2O/c1-13-18(20(24)17-10-16(21)6-7-19(17)22-13)12-23-9-8-14-4-2-3-5-15(14)11-23/h2-7,10H,8-9,11-12H2,1H3,(H,22,24)/p+1