[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-[2-(4-methoxyphenyl)ethyl]azanium

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-[2-(4-methoxyphenyl)ethyl]azanium Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium CAS Name: [2-(2-cyanoethylamino)-2-oxoethyl]-[2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl]-[2-(4-methoxyphenyl)ethyl]azanium Traditional Name: [2-(2-cyanoethylamino)-2-keto-ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC[NH2+]CC(=O)NCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)CC[NH2+]CC(=O)NCCC#N

InChI

InChI=1S/C14H19N3O2/c1-19-13-5-3-12(4-6-13)7-10-16-11-14(18)17-9-2-8-15/h3-6,16H,2,7,9-11H2,1H3,(H,17,18)/p+1