1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline

Systemtic Name: 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline Openeye Name: 1-[2-[4-(o-tolyl)piperazin-1-yl]ethyl]isoquinoline CAS Name: 1-[2-[4-(2-methylphenyl)-1-piperazinyl]ethyl]isoquinoline IUPAC Name: 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline Traditional Name: 1-[2-[4-(o-tolyl)piperazino]ethyl]isoquinoline Formula: C22H25N3 MolecularWeight: 331.454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCC3=NC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCC3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C22H25N3/c1-18-6-2-5-9-22(18)25-16-14-24(15-17-25)13-11-21-20-8-4-3-7-19(20)10-12-23-21/h2-10,12H,11,13-17H2,1H3