1-[2-(4-nitrophenyl)ethyl]-1,4-diazepane

Systemtic Name: 1-[2-(4-nitrophenyl)ethyl]-1,4-diazepane Openeye Name: 1-[2-(4-nitrophenyl)ethyl]-1,4-diazepane CAS Name: 1-[2-(4-nitrophenyl)ethyl]-1,4-diazepane IUPAC Name: 1-[2-(4-nitrophenyl)ethyl]-1,4-diazepane Traditional Name: 1-[2-(4-nitrophenyl)ethyl]-1,4-diazepane Formula: C13H19N3O2 MolecularWeight: 249.30886

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CNCCN(C1)CCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O2/c17-16(18)13-4-2-12(3-5-13)6-10-15-9-1-7-14-8-11-15/h2-5,14H,1,6-11H2