(3S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-yl]methyl]oxolane-3-carboxamide

Systemtic Name: (3S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-yl]methyl]oxolane-3-carboxamide Openeye Name: (3S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-yl]methyl]tetrahydrofuran-3-carboxamide CAS Name: (3S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridin-1-iumyl]methyl]-3-oxolanecarboxamide IUPAC Name: (3S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-yl]methyl]oxolane-3-carboxamide Traditional Name: (3S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-yl]methyl]tetrahydrofuran-3-carboxamide Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(=O)NCC2=C([NH+]=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1COC[C@H]1C(=O)NCC2=C([NH+]=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H23N3O2/c24-20(18-8-11-25-14-18)22-12-16-6-3-9-21-19(16)23-10-7-15-4-1-2-5-17(15)13-23/h1-6,9,18H,7-8,10-14H2,(H,22,24)/p+1/t18-/m0/s1