[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-[(2R)-2-cyanopropyl]-methyl-azanium

Systemtic Name: [2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-[(2R)-2-cyanopropyl]-methyl-azanium Openeye Name: [2-(2-chloroanilino)-2-oxo-ethyl]-[(2R)-2-cyanopropyl]-methyl-ammonium CAS Name: [2-(2-chloroanilino)-2-oxoethyl]-[(2R)-2-cyanopropyl]-methylammonium IUPAC Name: [2-(2-chloroanilino)-2-oxoethyl]-[(2R)-2-cyanopropyl]-methylazanium Traditional Name: [2-(2-chloroanilino)-2-keto-ethyl]-[(2R)-2-cyanopropyl]-methyl-ammonium Formula: C13H17ClN3O+ MolecularWeight: 266.74658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](C)CC(=O)NC1=CC=CC=C1Cl)C#N

Isomeric SMILES

C[C@H](C[NH+](C)CC(=O)NC1=CC=CC=C1Cl)C#N

InChI

InChI=1S/C13H16ClN3O/c1-10(7-15)8-17(2)9-13(18)16-12-6-4-3-5-11(12)14/h3-6,10H,8-9H2,1-2H3,(H,16,18)/p+1/t10-/m0/s1