[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-[(4-methylphenyl)methyl]azanium

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-[(4-methylphenyl)methyl]azanium Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl]-(p-tolylmethyl)ammonium CAS Name: [2-(2-cyanoethylamino)-2-oxoethyl]-[(4-methylphenyl)methyl]ammonium IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl]-[(4-methylphenyl)methyl]azanium Traditional Name: [2-(2-cyanoethylamino)-2-keto-ethyl]-(4-methylbenzyl)ammonium Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC(=O)NCCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC(=O)NCCC#N

InChI

InChI=1S/C13H17N3O/c1-11-3-5-12(6-4-11)9-15-10-13(17)16-8-2-7-14/h3-6,15H,2,8-10H2,1H3,(H,16,17)/p+1