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

Systemtic Name: (2R)-N-[2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]oxolane-2-carboxamide Openeye Name: (2R)-N-[2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]tetrahydrofuran-2-carboxamide CAS Name: (2R)-N-[2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-oxolanecarboxamide IUPAC Name: (2R)-N-[2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]oxolane-2-carboxamide Traditional Name: (2R)-N-[2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]tetrahydrofuran-2-carboxamide Formula: C23H25N2O2+ MolecularWeight: 361.4568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O2/c26-23(22-9-5-15-27-22)24-21-11-10-19-12-14-25(17-20(19)16-21)13-4-8-18-6-2-1-3-7-18/h1-3,6-7,10-11,16,22H,5,9,12-15,17H2,(H,24,26)/p+1/t22-/m1/s1