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

Systemtic Name: 7-chloranyl-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1H-quinazolin-4-one Formula: C20H21ClN3O3+ MolecularWeight: 386.85204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)OC

InChI

InChI=1S/C20H20ClN3O3/c1-26-17-7-12-5-6-24(10-13(12)8-18(17)27-2)11-19-22-16-9-14(21)3-4-15(16)20(25)23-19/h3-4,7-9H,5-6,10-11H2,1-2H3,(H,22,23,25)/p+1