(4S,5S,6R)-4-(4-chlorophenyl)-6-methyl-5-nitro-cyclohexene-1-carbaldehyde

Systemtic Name: (4S,5S,6R)-4-(4-chlorophenyl)-6-methyl-5-nitro-cyclohexene-1-carbaldehyde Openeye Name: (4S,5S,6R)-4-(4-chlorophenyl)-6-methyl-5-nitro-cyclohexene-1-carbaldehyde CAS Name: (4S,5S,6R)-4-(4-chlorophenyl)-6-methyl-5-nitro-1-cyclohexenecarboxaldehyde IUPAC Name: (4S,5S,6R)-4-(4-chlorophenyl)-6-methyl-5-nitrocyclohexene-1-carbaldehyde Traditional Name: (4S,5S,6R)-4-(4-chlorophenyl)-6-methyl-5-nitro-cyclohexene-1-carbaldehyde Formula: C14H14ClNO3 MolecularWeight: 279.71886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC=C1C=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1[C@@H]([C@@H](CC=C1C=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClNO3/c1-9-11(8-17)4-7-13(14(9)16(18)19)10-2-5-12(15)6-3-10/h2-6,8-9,13-14H,7H2,1H3/t9-,13+,14+/m1/s1