1-(4-ethylpiperazin-1-yl)-7-methoxy-3-phenyl-isoquinoline dihydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-7-methoxy-3-phenyl-isoquinoline dihydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-7-methoxy-3-phenyl-isoquinoline dihydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-7-methoxy-3-phenylisoquinoline dihydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-7-methoxy-3-phenylisoquinoline dihydrochloride Traditional Name: 1-(4-ethylpiperazino)-7-methoxy-3-phenyl-isoquinoline dihydrochloride Formula: C22H27Cl2N3O MolecularWeight: 420.37528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C=C(C=CC3=CC(=N2)C4=CC=CC=C4)OC.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C3C=C(C=CC3=CC(=N2)C4=CC=CC=C4)OC.Cl.Cl

InChI

InChI=1S/C22H25N3O.2ClH/c1-3-24-11-13-25(14-12-24)22-20-16-19(26-2)10-9-18(20)15-21(23-22)17-7-5-4-6-8-17;;/h4-10,15-16H,3,11-14H2,1-2H3;2*1H