1,4-diazepan-1-yl-(5-nitro-1H-pyrrol-2-yl)methanone

Systemtic Name: 1,4-diazepan-1-yl-(5-nitro-1H-pyrrol-2-yl)methanone Openeye Name: 1,4-diazepan-1-yl-(5-nitro-1H-pyrrol-2-yl)methanone CAS Name: 1,4-diazepan-1-yl-(5-nitro-1H-pyrrol-2-yl)methanone IUPAC Name: 1,4-diazepan-1-yl-(5-nitro-1H-pyrrol-2-yl)methanone Traditional Name: 1,4-diazepan-1-yl-(5-nitro-1H-pyrrol-2-yl)methanone Formula: C10H14N4O3 MolecularWeight: 238.24316

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC=C(N2)[N+](=O)[O-]

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC=C(N2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N4O3/c15-10(13-6-1-4-11-5-7-13)8-2-3-9(12-8)14(16)17/h2-3,11-12H,1,4-7H2