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

Systemtic Name: 3-[[(2R)-oxolan-2-yl]methylamino]-1-propyl-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Openeye Name: 1-propyl-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile CAS Name: 3-[[(2R)-2-oxolanyl]methylamino]-1-propyl-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile IUPAC Name: 3-[[(2R)-oxolan-2-yl]methylamino]-1-propyl-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Traditional Name: 1-propyl-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCCCC2=C(C(=[NH+]1)NCC3CCCO3)C#N

Isomeric SMILES

CCCC1=C2CCCCC2=C(C(=[NH+]1)NC[C@H]3CCCO3)C#N

InChI

InChI=1S/C18H25N3O/c1-2-6-17-15-9-4-3-8-14(15)16(11-19)18(21-17)20-12-13-7-5-10-22-13/h13H,2-10,12H2,1H3,(H,20,21)/p+1/t13-/m1/s1