1-butyl-3-[2-(2-hydroxyethyloxy)ethylamino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-butyl-3-[2-(2-hydroxyethyloxy)ethylamino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-butyl-3-[2-(2-hydroxyethoxy)ethylamino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-butyl-3-[2-(2-hydroxyethoxy)ethylamino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-butyl-3-[2-(2-hydroxyethoxy)ethylamino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-butyl-3-[2-(2-hydroxyethoxy)ethylamino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2CCCCC2=C(C(=N1)NCCOCCO)C#N

Isomeric SMILES

CCCCC1=C2CCCCC2=C(C(=N1)NCCOCCO)C#N

InChI

InChI=1S/C18H27N3O2/c1-2-3-8-17-15-7-5-4-6-14(15)16(13-19)18(21-17)20-9-11-23-12-10-22/h22H,2-12H2,1H3,(H,20,21)