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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)CN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)OC

InChI

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