2,3-dimethyl-5,6-bis[(1-nitrocycloheptyl)methyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3-dimethyl-5,6-bis[(1-nitrocycloheptyl)methyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,3-dimethyl-5,6-bis[(1-nitrocycloheptyl)methyl]-1,4-benzoquinone CAS Name: 2,3-dimethyl-5,6-bis[(1-nitrocycloheptyl)methyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,3-dimethyl-5,6-bis[(1-nitrocycloheptyl)methyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,3-dimethyl-5,6-bis[(1-nitrocycloheptyl)methyl]-p-benzoquinone Formula: C24H34N2O6 MolecularWeight: 446.53656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)CC2(CCCCCC2)[N+](=O)[O-])CC3(CCCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)CC2(CCCCCC2)[N+](=O)[O-])CC3(CCCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C24H34N2O6/c1-17-18(2)22(28)20(16-24(26(31)32)13-9-5-6-10-14-24)19(21(17)27)15-23(25(29)30)11-7-3-4-8-12-23/h3-16H2,1-2H3