4-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C27H25N3O4 MolecularWeight: 455.5051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H25N3O4/c1-33-23-14-18-12-13-30(26(17-8-4-3-5-9-17)21(18)15-24(23)34-2)25(31)16-22-19-10-6-7-11-20(19)27(32)29-28-22/h3-11,14-15,26H,12-13,16H2,1-2H3,(H,29,32)/t26-/m1/s1