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

Systemtic Name: 1,4-diazepan-1-yl-(1-ethyl-4-nitro-pyrrol-2-yl)methanone Openeye Name: 1,4-diazepan-1-yl-(1-ethyl-4-nitro-pyrrol-2-yl)methanone CAS Name: 1,4-diazepan-1-yl-(1-ethyl-4-nitro-2-pyrrolyl)methanone IUPAC Name: 1,4-diazepan-1-yl-(1-ethyl-4-nitropyrrol-2-yl)methanone Traditional Name: 1,4-diazepan-1-yl-(1-ethyl-4-nitro-pyrrol-2-yl)methanone Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)N2CCCNCC2)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C=C1C(=O)N2CCCNCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O3/c1-2-14-9-10(16(18)19)8-11(14)12(17)15-6-3-4-13-5-7-15/h8-9,13H,2-7H2,1H3