1-(4-ethylpiperazin-1-yl)-3-(3-methoxyphenyl)isoquinoline dihydrochloride

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=CC=C4)OC.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=CC=C4)OC.Cl.Cl

InChI

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