(2R)-N-[2-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]oxolane-2-carboxamide

Systemtic Name: (2R)-N-[2-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]oxolane-2-carboxamide Openeye Name: (2R)-N-[2-(3-pyridylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]tetrahydrofuran-2-carboxamide CAS Name: (2R)-N-[2-(3-pyridinylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-oxolanecarboxamide IUPAC Name: (2R)-N-[2-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]oxolane-2-carboxamide Traditional Name: (2R)-N-[2-(3-pyridylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]tetrahydrofuran-2-carboxamide Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)NC2=CC3=C(CC[NH+](C3)CC4=CN=CC=C4)C=C2

Isomeric SMILES

C1C[C@@H](OC1)C(=O)NC2=CC3=C(CC[NH+](C3)CC4=CN=CC=C4)C=C2

InChI

InChI=1S/C20H23N3O2/c24-20(19-4-2-10-25-19)22-18-6-5-16-7-9-23(14-17(16)11-18)13-15-3-1-8-21-12-15/h1,3,5-6,8,11-12,19H,2,4,7,9-10,13-14H2,(H,22,24)/p+1/t19-/m1/s1