3-[2-[(2-cyanoethanoylamino)methyl]phenoxy]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[(2-cyanoethanoylamino)methyl]phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[2-[[(2-cyanoacetyl)amino]methyl]phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[2-[[(2-cyano-1-oxoethyl)amino]methyl]phenoxy]propyl-dimethylammonium IUPAC Name: 3-[2-[[(2-cyanoacetyl)amino]methyl]phenoxy]propyl-dimethylazanium Traditional Name: 3-[2-[[(2-cyanoacetyl)amino]methyl]phenoxy]propyl-dimethyl-ammonium Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=CC=CC=C1CNC(=O)CC#N

Isomeric SMILES

C[NH+](C)CCCOC1=CC=CC=C1CNC(=O)CC#N

InChI

InChI=1S/C15H21N3O2/c1-18(2)10-5-11-20-14-7-4-3-6-13(14)12-17-15(19)8-9-16/h3-4,6-7H,5,8,10-12H2,1-2H3,(H,17,19)/p+1