[2-(cyanomethylamino)-2-oxidanylidene-ethyl]-phenethyl-azanium

Systemtic Name: [2-(cyanomethylamino)-2-oxidanylidene-ethyl]-phenethyl-azanium Openeye Name: [2-(cyanomethylamino)-2-oxo-ethyl]-phenethyl-ammonium CAS Name: [2-(cyanomethylamino)-2-oxoethyl]-phenethylammonium IUPAC Name: [2-(cyanomethylamino)-2-oxoethyl]-phenethylazanium Traditional Name: [2-(cyanomethylamino)-2-keto-ethyl]-phenethyl-ammonium Formula: C12H16N3O+ MolecularWeight: 218.27494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O/c13-7-9-15-12(16)10-14-8-6-11-4-2-1-3-5-11/h1-5,14H,6,8-10H2,(H,15,16)/p+1