1-(2-methylpropyl)-3-[[(2R)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile

Systemtic Name: 1-(2-methylpropyl)-3-[[(2R)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Openeye Name: 1-isobutyl-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile CAS Name: 1-(2-methylpropyl)-3-[[(2R)-2-oxolanyl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile IUPAC Name: 1-(2-methylpropyl)-3-[[(2R)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Traditional Name: 1-isobutyl-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Formula: C19H28N3O+ MolecularWeight: 314.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2CCCCC2=C(C(=[NH+]1)NCC3CCCO3)C#N

Isomeric SMILES

CC(C)CC1=C2CCCCC2=C(C(=[NH+]1)NC[C@H]3CCCO3)C#N

InChI

InChI=1S/C19H27N3O/c1-13(2)10-18-16-8-4-3-7-15(16)17(11-20)19(22-18)21-12-14-6-5-9-23-14/h13-14H,3-10,12H2,1-2H3,(H,21,22)/p+1/t14-/m1/s1