N-(cyanomethyl)-2-[(3,4-dichlorophenyl)-(2-iodanylethanoyl)amino]propanamide

Systemtic Name: N-(cyanomethyl)-2-[(3,4-dichlorophenyl)-(2-iodanylethanoyl)amino]propanamide Openeye Name: N-(cyanomethyl)-2-(3,4-dichloro-N-(2-iodoacetyl)anilino)propanamide CAS Name: N-(cyanomethyl)-2-(3,4-dichloro-N-(2-iodo-1-oxoethyl)anilino)propanamide IUPAC Name: N-(cyanomethyl)-2-(3,4-dichloro-N-(2-iodoacetyl)anilino)propanamide Traditional Name: N-(cyanomethyl)-2-(3,4-dichloro-N-(2-iodoacetyl)anilino)propionamide Formula: C13H12Cl2IN3O2 MolecularWeight: 440.06375

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#N)N(C1=CC(=C(C=C1)Cl)Cl)C(=O)CI

Isomeric SMILES

CC(C(=O)NCC#N)N(C1=CC(=C(C=C1)Cl)Cl)C(=O)CI

InChI

InChI=1S/C13H12Cl2IN3O2/c1-8(13(21)18-5-4-17)19(12(20)7-16)9-2-3-10(14)11(15)6-9/h2-3,6,8H,5,7H2,1H3,(H,18,21)