[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [2-(5-chloro-2-cyano-anilino)-2-keto-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C18H19ClN3O2+ MolecularWeight: 344.81536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C18H18ClN3O2/c1-22(9-10-24-16-5-3-2-4-6-16)13-18(23)21-17-11-15(19)8-7-14(17)12-20/h2-8,11H,9-10,13H2,1H3,(H,21,23)/p+1