2-[2-[2-(2-cyanoethanoylamino)ethyl]phenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[2-[2-(2-cyanoethanoylamino)ethyl]phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[2-[2-[(2-cyanoacetyl)amino]ethyl]phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[2-[2-[(2-cyano-1-oxoethyl)amino]ethyl]phenoxy]ethyl-diethylammonium IUPAC Name: 2-[2-[2-[(2-cyanoacetyl)amino]ethyl]phenoxy]ethyl-diethylazanium Traditional Name: 2-[2-[2-[(2-cyanoacetyl)amino]ethyl]phenoxy]ethyl-diethyl-ammonium Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=CC=C1CCNC(=O)CC#N

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=CC=C1CCNC(=O)CC#N

InChI

InChI=1S/C17H25N3O2/c1-3-20(4-2)13-14-22-16-8-6-5-7-15(16)10-12-19-17(21)9-11-18/h5-8H,3-4,9-10,12-14H2,1-2H3,(H,19,21)/p+1