2-(4-methyl-1,4-diazepan-1-yl)-1-(3-nitrophenyl)ethanone

Systemtic Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-(3-nitrophenyl)ethanone Openeye Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-(3-nitrophenyl)ethanone CAS Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-(3-nitrophenyl)ethanone IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-(3-nitrophenyl)ethanone Traditional Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-(3-nitrophenyl)ethanone Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCCN(CC1)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O3/c1-15-6-3-7-16(9-8-15)11-14(18)12-4-2-5-13(10-12)17(19)20/h2,4-5,10H,3,6-9,11H2,1H3