2-nitro-3-[4-[(2-nitro-3-oxidanylidene-cyclohexen-1-yl)amino]butylamino]cyclohex-2-en-1-one

Systemtic Name: 2-nitro-3-[4-[(2-nitro-3-oxidanylidene-cyclohexen-1-yl)amino]butylamino]cyclohex-2-en-1-one Openeye Name: 2-nitro-3-[4-[(2-nitro-3-oxo-cyclohexen-1-yl)amino]butylamino]cyclohex-2-en-1-one CAS Name: 2-nitro-3-[4-[(2-nitro-3-oxo-1-cyclohexenyl)amino]butylamino]-1-cyclohex-2-enone IUPAC Name: 2-nitro-3-[4-[(2-nitro-3-oxocyclohexen-1-yl)amino]butylamino]cyclohex-2-en-1-one Traditional Name: 3-[4-[(3-keto-2-nitro-cyclohexen-1-yl)amino]butylamino]-2-nitro-cyclohex-2-en-1-one Formula: C16H22N4O6 MolecularWeight: 366.36908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)C1)[N+](=O)[O-])NCCCCNC2=C(C(=O)CCC2)[N+](=O)[O-]

Isomeric SMILES

C1CC(=C(C(=O)C1)[N+](=O)[O-])NCCCCNC2=C(C(=O)CCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O6/c21-13-7-3-5-11(15(13)19(23)24)17-9-1-2-10-18-12-6-4-8-14(22)16(12)20(25)26/h17-18H,1-10H2