2-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-methyl-6-nitro-benzenecarbonitrile

Systemtic Name: 2-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-methyl-6-nitro-benzenecarbonitrile Openeye Name: 2-(4,4-dimethyl-2,6-dioxo-cyclohexyl)-3-methyl-6-nitro-benzonitrile CAS Name: 2-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-methyl-6-nitrobenzonitrile IUPAC Name: 2-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-methyl-6-nitrobenzonitrile Traditional Name: 2-(2,6-diketo-4,4-dimethyl-cyclohexyl)-3-methyl-6-nitro-benzonitrile Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])C#N)C2C(=O)CC(CC2=O)(C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])C#N)C2C(=O)CC(CC2=O)(C)C

InChI

InChI=1S/C16H16N2O4/c1-9-4-5-11(18(21)22)10(8-17)14(9)15-12(19)6-16(2,3)7-13(15)20/h4-5,15H,6-7H2,1-3H3