1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1,2,4-triazol-1-yl)propan-1-one Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCN3C=NC=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCN3C=NC=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H24N4O3/c1-28-19-12-17-8-11-26(21(27)9-10-25-15-23-14-24-25)22(16-6-4-3-5-7-16)18(17)13-20(19)29-2/h3-7,12-15,22H,8-11H2,1-2H3