[2-[(5-azanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-cyanoethyl)-methyl-azanium

Systemtic Name: [2-[(5-azanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-cyanoethyl)-methyl-azanium Openeye Name: [2-(5-amino-2-methyl-anilino)-2-oxo-ethyl]-(2-cyanoethyl)-methyl-ammonium CAS Name: [2-(5-amino-2-methylanilino)-2-oxoethyl]-(2-cyanoethyl)-methylammonium IUPAC Name: [2-(5-amino-2-methylanilino)-2-oxoethyl]-(2-cyanoethyl)-methylazanium Traditional Name: [2-(5-amino-2-methyl-anilino)-2-keto-ethyl]-(2-cyanoethyl)-methyl-ammonium Formula: C13H19N4O+ MolecularWeight: 247.31616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4O/c1-10-4-5-11(15)8-12(10)16-13(18)9-17(2)7-3-6-14/h4-5,8H,3,7,9,15H2,1-2H3,(H,16,18)/p+1