bis(2-cyanoethyl)-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: bis(2-cyanoethyl)-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: bis(2-cyanoethyl)-[2-(2,6-dimethylanilino)-2-oxo-ethyl]ammonium CAS Name: bis(2-cyanoethyl)-[2-(2,6-dimethylanilino)-2-oxoethyl]ammonium IUPAC Name: bis(2-cyanoethyl)-[2-(2,6-dimethylanilino)-2-oxoethyl]azanium Traditional Name: bis(2-cyanoethyl)-[2-(2,6-dimethylanilino)-2-keto-ethyl]ammonium Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CCC#N)CCC#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CCC#N)CCC#N

InChI

InChI=1S/C16H20N4O/c1-13-6-3-7-14(2)16(13)19-15(21)12-20(10-4-8-17)11-5-9-18/h3,6-7H,4-5,10-12H2,1-2H3,(H,19,21)/p+1