(4R,5S)-2-bromanyl-4-(2,4-dichlorophenyl)-5-nitro-cyclohexene-1-carbaldehyde

Systemtic Name: (4R,5S)-2-bromanyl-4-(2,4-dichlorophenyl)-5-nitro-cyclohexene-1-carbaldehyde Openeye Name: (4R,5S)-2-bromo-4-(2,4-dichlorophenyl)-5-nitro-cyclohexene-1-carbaldehyde CAS Name: (4R,5S)-2-bromo-4-(2,4-dichlorophenyl)-5-nitro-1-cyclohexenecarboxaldehyde IUPAC Name: (4R,5S)-2-bromo-4-(2,4-dichlorophenyl)-5-nitrocyclohexene-1-carbaldehyde Traditional Name: (4R,5S)-2-bromo-4-(2,4-dichlorophenyl)-5-nitro-cyclohexene-1-carbaldehyde Formula: C13H10BrCl2NO3 MolecularWeight: 379.0334

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CC(=C1Br)C=O)[N+](=O)[O-])C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1[C@@H]([C@H](CC(=C1Br)C=O)[N+](=O)[O-])C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H10BrCl2NO3/c14-11-5-10(9-2-1-8(15)4-12(9)16)13(17(19)20)3-7(11)6-18/h1-2,4,6,10,13H,3,5H2/t10-,13+/m1/s1