(3R)-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-ium-1-yl]oxolan-2-one

Systemtic Name: (3R)-3-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-ium-1-yl]oxolan-2-one Openeye Name: (3R)-3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-ium-1-yl]tetrahydrofuran-2-one CAS Name: (3R)-3-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-piperidin-1-iumyl]-2-oxolanone IUPAC Name: (3R)-3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-ium-1-yl]oxolan-2-one Traditional Name: (3R)-3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-ium-1-yl]tetrahydrofuran-2-one Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCC3=CC=CC=C3C2)C4CCOC4=O

Isomeric SMILES

C1COC(=O)[C@@H]1[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H24N2O3/c22-18(21-11-5-14-3-1-2-4-16(14)13-21)15-6-9-20(10-7-15)17-8-12-24-19(17)23/h1-4,15,17H,5-13H2/p+1/t17-/m1/s1