(1S,2S)-2-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrophenyl)-5,7-dioxaspiro[2.5]octane-4,8-dione

Systemtic Name: (1S,2S)-2-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrophenyl)-5,7-dioxaspiro[2.5]octane-4,8-dione Openeye Name: (1S,2S)-2-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrophenyl)-5,7-dioxaspiro[2.5]octane-4,8-dione CAS Name: (1S,2S)-2-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrophenyl)-5,7-dioxaspiro[2.5]octane-4,8-dione IUPAC Name: (1S,2S)-2-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrophenyl)-5,7-dioxaspiro[2.5]octane-4,8-dione Traditional Name: (1S,2S)-2-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrophenyl)-5,7-dioxaspiro[2.5]octane-4,8-quinone Formula: C20H16ClNO6 MolecularWeight: 401.79714

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C2(C(C2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C2([C@@H]([C@H]2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)O1)C

InChI

InChI=1S/C20H16ClNO6/c1-19(2)27-17(23)20(18(24)28-19)15(11-3-7-13(21)8-4-11)16(20)12-5-9-14(10-6-12)22(25)26/h3-10,15-16H,1-2H3/t15-,16-/m1/s1