2-[4-[2-(2-cyanoethanoylamino)ethyl]-2-ethoxy-phenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[4-[2-(2-cyanoethanoylamino)ethyl]-2-ethoxy-phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[4-[2-[(2-cyanoacetyl)amino]ethyl]-2-ethoxy-phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[4-[2-[(2-cyano-1-oxoethyl)amino]ethyl]-2-ethoxyphenoxy]ethyl-diethylammonium IUPAC Name: 2-[4-[2-[(2-cyanoacetyl)amino]ethyl]-2-ethoxyphenoxy]ethyl-diethylazanium Traditional Name: 2-[4-[2-[(2-cyanoacetyl)amino]ethyl]-2-ethoxy-phenoxy]ethyl-diethyl-ammonium Formula: C19H30N3O3+ MolecularWeight: 348.4598

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C=C(C=C1)CCNC(=O)CC#N)OCC

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C=C(C=C1)CCNC(=O)CC#N)OCC

InChI

InChI=1S/C19H29N3O3/c1-4-22(5-2)13-14-25-17-8-7-16(15-18(17)24-6-3)10-12-21-19(23)9-11-20/h7-8,15H,4-6,9-10,12-14H2,1-3H3,(H,21,23)/p+1