(2-bromophenyl)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)methanone

Systemtic Name: (2-bromophenyl)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)methanone Openeye Name: (2-bromophenyl)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)methanone CAS Name: (2-bromophenyl)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)methanone IUPAC Name: (2-bromophenyl)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)methanone Traditional Name: (2-bromophenyl)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)methanone Formula: C18H17BrNO3+ MolecularWeight: 375.23648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=[N+](CCC2=C1)C(=O)C3=CC=CC=C3Br)OC

Isomeric SMILES

COC1=C(C=C2C=[N+](CCC2=C1)C(=O)C3=CC=CC=C3Br)OC

InChI

InChI=1S/C18H17BrNO3/c1-22-16-9-12-7-8-20(11-13(12)10-17(16)23-2)18(21)14-5-3-4-6-15(14)19/h3-6,9-11H,7-8H2,1-2H3/q+1