4-nitro-N-[(1R,2R)-1,3,3-trimethyl-2-oxidanyl-2-[(E)-3-oxidanylidenebut-1-enyl]cyclohexyl]benzamide

Systemtic Name: 4-nitro-N-[(1R,2R)-1,3,3-trimethyl-2-oxidanyl-2-[(E)-3-oxidanylidenebut-1-enyl]cyclohexyl]benzamide Openeye Name: N-[(1R,2R)-2-hydroxy-1,3,3-trimethyl-2-[(E)-3-oxobut-1-enyl]cyclohexyl]-4-nitro-benzamide CAS Name: N-[(1R,2R)-2-hydroxy-1,3,3-trimethyl-2-[(E)-3-oxobut-1-enyl]cyclohexyl]-4-nitrobenzamide IUPAC Name: N-[(1R,2R)-2-hydroxy-1,3,3-trimethyl-2-[(E)-3-oxobut-1-enyl]cyclohexyl]-4-nitrobenzamide Traditional Name: N-[(1R,2R)-2-hydroxy-2-[(E)-3-ketobut-1-enyl]-1,3,3-trimethyl-cyclohexyl]-4-nitro-benzamide Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1(C(CCCC1(C)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CC(=O)/C=C/[C@@]1([C@](CCCC1(C)C)(C)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C20H26N2O5/c1-14(23)10-13-20(25)18(2,3)11-5-12-19(20,4)21-17(24)15-6-8-16(9-7-15)22(26)27/h6-10,13,25H,5,11-12H2,1-4H3,(H,21,24)/b13-10+/t19-,20-/m1/s1