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

Systemtic Name: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-(5-chloro-2-cyano-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C17H17ClN3O+ MolecularWeight: 314.78938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O/c1-21(11-13-5-3-2-4-6-13)12-17(22)20-16-9-15(18)8-7-14(16)10-19/h2-9H,11-12H2,1H3,(H,20,22)/p+1