2-(2,6-ditert-butyl-4-methoxy-phenyl)-6-methoxy-5-methoxycarbonyl-2-nitro-6-oxidanylidene-hexanoic acid

Systemtic Name: 2-(2,6-ditert-butyl-4-methoxy-phenyl)-6-methoxy-5-methoxycarbonyl-2-nitro-6-oxidanylidene-hexanoic acid Openeye Name: 2-(2,6-ditert-butyl-4-methoxy-phenyl)-6-methoxy-5-methoxycarbonyl-2-nitro-6-oxo-hexanoic acid CAS Name: 2-(2,6-ditert-butyl-4-methoxyphenyl)-6-methoxy-5-methoxycarbonyl-2-nitro-6-oxohexanoic acid IUPAC Name: 2-(2,6-ditert-butyl-4-methoxyphenyl)-6-methoxy-5-methoxycarbonyl-2-nitro-6-oxohexanoic acid Traditional Name: 5-carbomethoxy-2-(2,6-ditert-butyl-4-methoxy-phenyl)-6-keto-6-methoxy-2-nitro-hexanoic acid Formula: C24H35NO9 MolecularWeight: 481.536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1C(CCC(C(=O)OC)C(=O)OC)(C(=O)O)[N+](=O)[O-])C(C)(C)C)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1C(CCC(C(=O)OC)C(=O)OC)(C(=O)O)[N+](=O)[O-])C(C)(C)C)OC

InChI

InChI=1S/C24H35NO9/c1-22(2,3)16-12-14(32-7)13-17(23(4,5)6)18(16)24(21(28)29,25(30)31)11-10-15(19(26)33-8)20(27)34-9/h12-13,15H,10-11H2,1-9H3,(H,28,29)