3-[1-[(2-cyanoethanoylamino)methyl]naphthalen-2-yl]oxypropyl-dimethyl-azanium

Systemtic Name: 3-[1-[(2-cyanoethanoylamino)methyl]naphthalen-2-yl]oxypropyl-dimethyl-azanium Openeye Name: 3-[[1-[[(2-cyanoacetyl)amino]methyl]-2-naphthyl]oxy]propyl-dimethyl-ammonium CAS Name: 3-[[1-[[(2-cyano-1-oxoethyl)amino]methyl]-2-naphthalenyl]oxy]propyl-dimethylammonium IUPAC Name: 3-[1-[[(2-cyanoacetyl)amino]methyl]naphthalen-2-yl]oxypropyl-dimethylazanium Traditional Name: 3-[1-[[(2-cyanoacetyl)amino]methyl]-2-naphthoxy]propyl-dimethyl-ammonium Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=C(C2=CC=CC=C2C=C1)CNC(=O)CC#N

Isomeric SMILES

C[NH+](C)CCCOC1=C(C2=CC=CC=C2C=C1)CNC(=O)CC#N

InChI

InChI=1S/C19H23N3O2/c1-22(2)12-5-13-24-18-9-8-15-6-3-4-7-16(15)17(18)14-21-19(23)10-11-20/h3-4,6-9H,5,10,12-14H2,1-2H3,(H,21,23)/p+1