(1-oxidanidylpyridin-1-ium-3-yl)-[2-(phenylmethyl)pyrrolidin-1-yl]methanone

Systemtic Name: (1-oxidanidylpyridin-1-ium-3-yl)-[2-(phenylmethyl)pyrrolidin-1-yl]methanone Openeye Name: (2-benzylpyrrolidin-1-yl)-(1-oxidopyridin-1-ium-3-yl)methanone CAS Name: (1-oxido-3-pyridin-1-iumyl)-[2-(phenylmethyl)-1-pyrrolidinyl]methanone IUPAC Name: (2-benzylpyrrolidin-1-yl)-(1-oxidopyridin-1-ium-3-yl)methanone Traditional Name: (2-benzylpyrrolidino)-(1-oxidopyridin-1-ium-3-yl)methanone Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=C[N+](=CC=C2)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CC(N(C1)C(=O)C2=C[N+](=CC=C2)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O2/c20-17(15-8-4-10-18(21)13-15)19-11-5-9-16(19)12-14-6-2-1-3-7-14/h1-4,6-8,10,13,16H,5,9,11-12H2