2-methylpropyl-(oxidanylidenemethylidene)-[1-(5-phenyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidin-2-yl]carbonyl-azanium

Systemtic Name: 2-methylpropyl-(oxidanylidenemethylidene)-[1-(5-phenyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidin-2-yl]carbonyl-azanium Openeye Name: isobutyl-(oxomethylene)-[1-(5-phenyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carbonyl]ammonium CAS Name: 2-methylpropyl-(oxomethylidene)-[oxo-[1-(5-phenyl-1,2,4-oxadiazol-2-ium-2-yl)-2-pyrrolidinyl]methyl]ammonium IUPAC Name: 2-methylpropyl-(oxomethylidene)-[1-(5-phenyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carbonyl]azanium Traditional Name: isobutyl-(ketomethylene)-[1-(5-phenyl-1,2,4-oxadiazol-2-ium-2-yl)prolyl]ammonium Formula: C18H22N4O3+2 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+](=C=O)C(=O)C1CCCN1[N+]2=CN=C(O2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C[N+](=C=O)C(=O)C1CCCN1[N+]2=CN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O3/c1-14(2)11-20(13-23)18(24)16-9-6-10-21(16)22-12-19-17(25-22)15-7-4-3-5-8-15/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3/q+2