5-pyrrolidin-1-ylsulfonyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridin-2-one

Systemtic Name: 5-pyrrolidin-1-ylsulfonyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridin-2-one Openeye Name: 5-pyrrolidin-1-ylsulfonyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridin-2-one CAS Name: 5-(1-pyrrolidinylsulfonyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-pyridinone IUPAC Name: 5-pyrrolidin-1-ylsulfonyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridin-2-one Traditional Name: 5-pyrrolidinosulfonyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-pyridone Formula: C19H24N3O3S+ MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN(C(=O)C=C2)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN(C(=O)C=C2)C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H23N3O3S/c23-19-8-7-18(26(24,25)22-10-3-4-11-22)14-21(19)15-20-12-9-16-5-1-2-6-17(16)13-20/h1-2,5-8,14H,3-4,9-13,15H2/p+1