[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-(4-cyanoanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(4-cyanoanilino)-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-(4-cyanoanilino)-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-(4-cyanoanilino)-2-keto-ethyl]-methyl-ammonium Formula: C17H18N3O+ MolecularWeight: 280.34432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O/c1-20(12-15-5-3-2-4-6-15)13-17(21)19-16-9-7-14(11-18)8-10-16/h2-10H,12-13H2,1H3,(H,19,21)/p+1