(E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one

Systemtic Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one Openeye Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one CAS Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-2-buten-1-one IUPAC Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methylbut-2-en-1-one Traditional Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one Formula: C22H25NO3 MolecularWeight: 351.4388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3)OC)OC

Isomeric SMILES

C/C=C(\C)/C(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C22H25NO3/c1-5-15(2)22(24)23-12-11-17-13-19(25-3)20(26-4)14-18(17)21(23)16-9-7-6-8-10-16/h5-10,13-14,21H,11-12H2,1-4H3/b15-5+