2-cyanoethyl-(2-methylpropyl)-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]azanium

Systemtic Name: 2-cyanoethyl-(2-methylpropyl)-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]azanium Openeye Name: 2-cyanoethyl-isobutyl-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]ammonium CAS Name: 2-cyanoethyl-(2-methylpropyl)-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]ammonium IUPAC Name: 2-cyanoethyl-(2-methylpropyl)-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]azanium Traditional Name: 2-cyanoethyl-isobutyl-[2-keto-2-(1H-pyrrol-2-yl)ethyl]ammonium Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CCC#N)CC(=O)C1=CC=CN1

Isomeric SMILES

CC(C)C[NH+](CCC#N)CC(=O)C1=CC=CN1

InChI

InChI=1S/C13H19N3O/c1-11(2)9-16(8-4-6-14)10-13(17)12-5-3-7-15-12/h3,5,7,11,15H,4,8-10H2,1-2H3/p+1