2-[[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]azaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]azaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(4-cyanoanilino)-2-oxo-ethyl]ammonio]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(4-cyanoanilino)-2-oxoethyl]ammonio]ethyl-dimethylammonium IUPAC Name: 2-[[2-(4-cyanoanilino)-2-oxoethyl]azaniumyl]ethyl-dimethylazanium Traditional Name: 2-[[2-(4-cyanoanilino)-2-keto-ethyl]ammonio]ethyl-dimethyl-ammonium Formula: C13H20N4O+2 MolecularWeight: 248.3241

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CC(=O)NC1=CC=C(C=C1)C#N

Isomeric SMILES

C[NH+](C)CC[NH2+]CC(=O)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H18N4O/c1-17(2)8-7-15-10-13(18)16-12-5-3-11(9-14)4-6-12/h3-6,15H,7-8,10H2,1-2H3,(H,16,18)/p+2