1-ethyl-4-(3-nitrophenyl)-1,4-diazepane

Systemtic Name: 1-ethyl-4-(3-nitrophenyl)-1,4-diazepane Openeye Name: 1-ethyl-4-(3-nitrophenyl)-1,4-diazepane CAS Name: 1-ethyl-4-(3-nitrophenyl)-1,4-diazepane IUPAC Name: 1-ethyl-4-(3-nitrophenyl)-1,4-diazepane Traditional Name: 1-ethyl-4-(3-nitrophenyl)-1,4-diazepane Formula: C13H19N3O2 MolecularWeight: 249.30886

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCN(CC1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN1CCCN(CC1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O2/c1-2-14-7-4-8-15(10-9-14)12-5-3-6-13(11-12)16(17)18/h3,5-6,11H,2,4,7-10H2,1H3