2-[(1R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-1H-quinazolin-4-one Formula: C21H24N3O3+ MolecularWeight: 366.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C21H23N3O3/c1-13(20-22-17-7-5-4-6-16(17)21(25)23-20)24-9-8-14-10-18(26-2)19(27-3)11-15(14)12-24/h4-7,10-11,13H,8-9,12H2,1-3H3,(H,22,23,25)/p+1/t13-/m1/s1