[(1R)-2-(2-cyanoethanoylamino)-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-(2-cyanoethanoylamino)-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(2-cyanoacetyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[(2-cyano-1-oxoethyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(2-cyanoacetyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-[(2-cyanoacetyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CC#N)C1=CC(=CC=C1)OC

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)CC#N)C1=CC(=CC=C1)OC

InChI

InChI=1S/C14H19N3O2/c1-17(2)13(10-16-14(18)7-8-15)11-5-4-6-12(9-11)19-3/h4-6,9,13H,7,10H2,1-3H3,(H,16,18)/p+1/t13-/m0/s1