4-(1-oxidanidyl-3,4-dihydro-2H-pyrrol-1-ium-2-yl)-3-oxidanyl-butanenitrile

Systemtic Name: 4-(1-oxidanidyl-3,4-dihydro-2H-pyrrol-1-ium-2-yl)-3-oxidanyl-butanenitrile Openeye Name: 3-hydroxy-4-(1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl)butanenitrile CAS Name: 3-hydroxy-4-(1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl)butanenitrile IUPAC Name: 3-hydroxy-4-(1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl)butanenitrile Traditional Name: 3-hydroxy-4-(1-oxido-1-pyrrolin-1-ium-2-yl)butyronitrile Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](=C1)[O-])CC(CC#N)O

Isomeric SMILES

C1CC([N+](=C1)[O-])CC(CC#N)O

InChI

InChI=1S/C8H12N2O2/c9-4-3-8(11)6-7-2-1-5-10(7)12/h5,7-8,11H,1-3,6H2