(6-bromanyl-2,3-dimethoxy-phenyl)-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)methanone

Systemtic Name: (6-bromanyl-2,3-dimethoxy-phenyl)-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)methanone Openeye Name: (6-bromo-2,3-dimethoxy-phenyl)-(6,7-dimethoxy-1-methylene-3,4-dihydroisoquinolin-2-yl)methanone CAS Name: (6-bromo-2,3-dimethoxyphenyl)-(6,7-dimethoxy-1-methylene-3,4-dihydroisoquinolin-2-yl)methanone IUPAC Name: (6-bromo-2,3-dimethoxyphenyl)-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)methanone Traditional Name: (6-bromo-2,3-dimethoxy-phenyl)-(6,7-dimethoxy-1-methylene-3,4-dihydroisoquinolin-2-yl)methanone Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Br)C(=O)N2CCC3=CC(=C(C=C3C2=C)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)Br)C(=O)N2CCC3=CC(=C(C=C3C2=C)OC)OC)OC

InChI

InChI=1S/C21H22BrNO5/c1-12-14-11-18(27-4)17(26-3)10-13(14)8-9-23(12)21(24)19-15(22)6-7-16(25-2)20(19)28-5/h6-7,10-11H,1,8-9H2,2-5H3