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

Systemtic Name: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-ethylazanium Traditional Name: benzyl-[2-(5-chloro-2-cyano-anilino)-2-keto-ethyl]-ethyl-ammonium Formula: C18H19ClN3O+ MolecularWeight: 328.81596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C18H18ClN3O/c1-2-22(12-14-6-4-3-5-7-14)13-18(23)21-17-10-16(19)9-8-15(17)11-20/h3-10H,2,12-13H2,1H3,(H,21,23)/p+1