1-(4-ethylpiperazin-1-yl)-6-methyl-3-(2-methylphenyl)isoquinoline chloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-6-methyl-3-(2-methylphenyl)isoquinoline chloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-6-methyl-3-(o-tolyl)isoquinoline chloride CAS Name: 1-(4-ethyl-1-piperazinyl)-6-methyl-3-(2-methylphenyl)isoquinoline chloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-6-methyl-3-(2-methylphenyl)isoquinoline chloride Traditional Name: 1-(4-ethylpiperazino)-6-methyl-3-(o-tolyl)isoquinoline chloride Formula: C23H27ClN3- MolecularWeight: 380.93358

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C=CC(=CC3=CC(=N2)C4=CC=CC=C4C)C.[Cl-]

Isomeric SMILES

CCN1CCN(CC1)C2=C3C=CC(=CC3=CC(=N2)C4=CC=CC=C4C)C.[Cl-]

InChI

InChI=1S/C23H27N3.ClH/c1-4-25-11-13-26(14-12-25)23-21-10-9-17(2)15-19(21)16-22(24-23)20-8-6-5-7-18(20)3;/h5-10,15-16H,4,11-14H2,1-3H3;1H/p-1