4-methyl-N-[2,4,5-tris(chloranyl)phenyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-methyl-N-[2,4,5-tris(chloranyl)phenyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-methyl-N-(2,4,5-trichlorophenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-methyl-N-(2,4,5-trichlorophenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-methyl-N-(2,4,5-trichlorophenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-methyl-N-(2,4,5-trichlorophenyl)-1,4-diazepane-1-carboxamide Formula: C13H16Cl3N3O MolecularWeight: 336.64464

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CN1CCCN(CC1)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C13H16Cl3N3O/c1-18-3-2-4-19(6-5-18)13(20)17-12-8-10(15)9(14)7-11(12)16/h7-8H,2-6H2,1H3,(H,17,20)