7-chloranyl-2,8-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one

Systemtic Name: 7-chloranyl-2,8-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one Openeye Name: 7-chloro-2,8-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one CAS Name: 7-chloro-2,8-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one IUPAC Name: 7-chloro-2,8-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-quinolin-4-one Traditional Name: 7-chloro-2,8-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-4-quinolone Formula: C21H22ClN2O+ MolecularWeight: 353.86518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1NC(=C(C2=O)C[NH+]3CCC4=CC=CC=C4C3)C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1NC(=C(C2=O)C[NH+]3CCC4=CC=CC=C4C3)C)Cl

InChI

InChI=1S/C21H21ClN2O/c1-13-19(22)8-7-17-20(13)23-14(2)18(21(17)25)12-24-10-9-15-5-3-4-6-16(15)11-24/h3-8H,9-12H2,1-2H3,(H,23,25)/p+1