3,3-dimethyl-4-[2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethanoyl]-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-[2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetyl]-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetyl]-1H-quinoxalin-2-one Traditional Name: 3,3-dimethyl-4-[2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetyl]-1H-quinoxalin-2-one Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[N+]3=CC4=C(CCCC4)C=C3)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[N+]3=CC4=C(CCCC4)C=C3)C

InChI

InChI=1S/C21H23N3O2/c1-21(2)20(26)22-17-9-5-6-10-18(17)24(21)19(25)14-23-12-11-15-7-3-4-8-16(15)13-23/h5-6,9-13H,3-4,7-8,14H2,1-2H3/p+1