2-(2-chloranyl-4-nitro-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone CAS Name: 2-(2-chloro-4-nitrophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone Formula: C14H18ClN3O4 MolecularWeight: 327.76342

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN1CCCN(CC1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H18ClN3O4/c1-16-5-2-6-17(8-7-16)14(19)10-22-13-4-3-11(18(20)21)9-12(13)15/h3-4,9H,2,5-8,10H2,1H3