[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (8S,9R,10S)-10-nitro-7-oxidanylidene-8-prop-2-enyl-1,4-dioxaspiro[4.5]decane-9-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (8S,9R,10S)-10-nitro-7-oxidanylidene-8-prop-2-enyl-1,4-dioxaspiro[4.5]decane-9-carboxylate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (8S,9R,10S)-8-allyl-10-nitro-7-oxo-1,4-dioxaspiro[4.5]decane-9-carboxylate CAS Name: (8S,9R,10S)-10-nitro-7-oxo-8-prop-2-enyl-1,4-dioxaspiro[4.5]decane-9-carboxylic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (8S,9R,10S)-10-nitro-7-oxo-8-prop-2-enyl-1,4-dioxaspiro[4.5]decane-9-carboxylate Traditional Name: (8S,9R,10S)-8-allyl-7-keto-10-nitro-1,4-dioxaspiro[4.5]decane-9-carboxylic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C28H37NO7 MolecularWeight: 499.59588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2C(C(=O)CC3(C2[N+](=O)[O-])OCCO3)CC=C)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@@H]2[C@@H](C(=O)CC3([C@H]2[N+](=O)[O-])OCCO3)CC=C)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C28H37NO7/c1-5-9-20-22(30)17-28(34-14-15-35-28)25(29(32)33)24(20)26(31)36-23-16-18(2)12-13-21(23)27(3,4)19-10-7-6-8-11-19/h5-8,10-11,18,20-21,23-25H,1,9,12-17H2,2-4H3/t18-,20-,21-,23-,24-,25+/m1/s1