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

Systemtic Name: 3-[3-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 3-[3-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 3-[3-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 3-[3-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-keto-propyl]quinazolin-4-one Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)CCN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C28H27N3O4/c1-34-24-16-20-12-15-31(27(19-8-4-3-5-9-19)22(20)17-25(24)35-2)26(32)13-14-30-18-29-23-11-7-6-10-21(23)28(30)33/h3-11,16-18,27H,12-15H2,1-2H3/t27-/m1/s1