3-[2-[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C28H24N3O6- MolecularWeight: 498.50666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-])C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2[C@@H](N(CCC2=C1)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-])C5=CC=CC=C5)OC

InChI

InChI=1S/C28H25N3O6/c1-36-22-14-18-12-13-30(26(17-8-4-3-5-9-17)21(18)15-23(22)37-2)24(32)16-31-27(33)20-11-7-6-10-19(20)25(29-31)28(34)35/h3-11,14-15,26H,12-13,16H2,1-2H3,(H,34,35)/p-1/t26-/m0/s1