[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-[(3-cyanophenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-[(3-cyanophenyl)methyl]-methyl-azanium Openeye Name: [2-(4-chloroanilino)-2-oxo-ethyl]-[(3-cyanophenyl)methyl]-methyl-ammonium CAS Name: [2-(4-chloroanilino)-2-oxoethyl]-[(3-cyanophenyl)methyl]-methylammonium IUPAC Name: [2-(4-chloroanilino)-2-oxoethyl]-[(3-cyanophenyl)methyl]-methylazanium Traditional Name: [2-(4-chloroanilino)-2-keto-ethyl]-(3-cyanobenzyl)-methyl-ammonium Formula: C17H17ClN3O+ MolecularWeight: 314.78938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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