1-butyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-butyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-butyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-butyl-3-[4-(2-hydroxyethyl)-1-piperazinyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-butyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-butyl-3-[4-(2-hydroxyethyl)piperazino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C20H30N4O MolecularWeight: 342.4784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)CCO)C#N

Isomeric SMILES

CCCCC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)CCO)C#N

InChI

InChI=1S/C20H30N4O/c1-2-3-8-19-17-7-5-4-6-16(17)18(15-21)20(22-19)24-11-9-23(10-12-24)13-14-25/h25H,2-14H2,1H3