trimethyl (1R,2R,3R,4R,5S)-2-(2-methoxy-2-oxidanylidene-ethyl)-4-[(E)-2-(2-nitrophenyl)ethenyl]-2-oxidanyl-6-oxidanylidene-cyclohexane-1,3,5-tricarboxylate

Systemtic Name: trimethyl (1R,2R,3R,4R,5S)-2-(2-methoxy-2-oxidanylidene-ethyl)-4-[(E)-2-(2-nitrophenyl)ethenyl]-2-oxidanyl-6-oxidanylidene-cyclohexane-1,3,5-tricarboxylate Openeye Name: trimethyl (1R,2R,3R,4R,5S)-2-hydroxy-2-(2-methoxy-2-oxo-ethyl)-4-[(E)-2-(2-nitrophenyl)vinyl]-6-oxo-cyclohexane-1,3,5-tricarboxylate CAS Name: (1R,2R,3R,4R,5S)-2-hydroxy-2-(2-methoxy-2-oxoethyl)-4-[(E)-2-(2-nitrophenyl)ethenyl]-6-oxocyclohexane-1,3,5-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (1R,2R,3R,4R,5S)-2-hydroxy-2-(2-methoxy-2-oxoethyl)-4-[(E)-2-(2-nitrophenyl)ethenyl]-6-oxocyclohexane-1,3,5-tricarboxylate Traditional Name: (1R,2R,3R,5S,6R)-2-hydroxy-4-keto-2-(2-keto-2-methoxy-ethyl)-6-[(E)-2-(2-nitrophenyl)vinyl]cyclohexane-1,3,5-tricarboxylic acid trimethyl ester Formula: C23H25NO12 MolecularWeight: 507.4441

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(C(C(C(C(=O)C1C(=O)OC)C(=O)OC)C=CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC)O

Isomeric SMILES

COC(=O)C[C@]1([C@@H]([C@H]([C@@H](C(=O)[C@@H]1C(=O)OC)C(=O)OC)/C=C/C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)O

InChI

InChI=1S/C23H25NO12/c1-33-15(25)11-23(30)17(21(28)35-3)13(10-9-12-7-5-6-8-14(12)24(31)32)16(20(27)34-2)19(26)18(23)22(29)36-4/h5-10,13,16-18,30H,11H2,1-4H3/b10-9+/t13-,16-,17-,18+,23+/m0/s1