9,10-dimethoxy-3-phenethyl-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinoline-1-carbonitrile hydrochloride

Systemtic Name: 9,10-dimethoxy-3-phenethyl-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinoline-1-carbonitrile hydrochloride Openeye Name: 9,10-dimethoxy-3-phenethyl-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinoline-1-carbonitrile hydrochloride CAS Name: 9,10-dimethoxy-3-phenethyl-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinoline-1-carbonitrile hydrochloride IUPAC Name: 9,10-dimethoxy-3-phenethyl-2,4,6,7-tetrahydropyrimido[6,1-a]isoquinoline-1-carbonitrile hydrochloride Traditional Name: 9,10-dimethoxy-3-phenethyl-2,4,6,7-tetrahydropyrimid[6,1-a]isoquinoline-1-carbonitrile hydrochloride Formula: C23H26ClN3O2 MolecularWeight: 411.92444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=C(CN(C3)CCC4=CC=CC=C4)C#N)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=C(CN(C3)CCC4=CC=CC=C4)C#N)OC.Cl

InChI

InChI=1S/C23H25N3O2.ClH/c1-27-21-12-18-9-11-26-16-25(10-8-17-6-4-3-5-7-17)15-19(14-24)23(26)20(18)13-22(21)28-2;/h3-7,12-13H,8-11,15-16H2,1-2H3;1H