N-(3-chloranyl-4-methyl-phenyl)-2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(1,4-diazepan-1-yl)-2-oxo-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-(1,4-diazepan-1-yl)-2-oxoacetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(1,4-diazepan-1-yl)-2-oxoacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(1,4-diazepan-1-yl)-2-keto-acetamide Formula: C14H18ClN3O2 MolecularWeight: 295.76462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)N2CCCNCC2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)N2CCCNCC2)Cl

InChI

InChI=1S/C14H18ClN3O2/c1-10-3-4-11(9-12(10)15)17-13(19)14(20)18-7-2-5-16-6-8-18/h3-4,9,16H,2,5-8H2,1H3,(H,17,19)