1-[5-[(2-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)oxymethyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: 1-[5-[(2-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)oxymethyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: 1-[5-[(2-chloro-1-oxido-pyridin-1-ium-3-yl)oxymethyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: 1-[[5-[(2-chloro-1-oxido-3-pyridin-1-iumyl)oxymethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[5-[(2-chloro-1-oxidopyridin-1-ium-3-yl)oxymethyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[5-[(2-chloro-1-oxido-pyridin-1-ium-3-yl)oxymethyl]prolyl]pyrrolidine-2-carbonitrile Formula: C16H19ClN4O3 MolecularWeight: 350.80006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C([N+](=CC=C3)[O-])Cl)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C([N+](=CC=C3)[O-])Cl)C#N

InChI

InChI=1S/C16H19ClN4O3/c17-15-14(4-2-8-21(15)23)24-10-11-5-6-13(19-11)16(22)20-7-1-3-12(20)9-18/h2,4,8,11-13,19H,1,3,5-7,10H2