2-chloranyl-6-methyl-5-methylsulfonyl-5-nitro-cyclohexa-1,3-diene

Systemtic Name: 2-chloranyl-6-methyl-5-methylsulfonyl-5-nitro-cyclohexa-1,3-diene Openeye Name: 2-chloro-6-methyl-5-methylsulfonyl-5-nitro-cyclohexa-1,3-diene CAS Name: 2-chloro-6-methyl-5-methylsulfonyl-5-nitrocyclohexa-1,3-diene IUPAC Name: 2-chloro-6-methyl-5-methylsulfonyl-5-nitrocyclohexa-1,3-diene Traditional Name: 2-chloro-5-mesyl-6-methyl-5-nitro-cyclohexa-1,3-diene Formula: C8H10ClNO4S MolecularWeight: 251.6873

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C=CC1([N+](=O)[O-])S(=O)(=O)C)Cl

Isomeric SMILES

CC1C=C(C=CC1([N+](=O)[O-])S(=O)(=O)C)Cl

InChI

InChI=1S/C8H10ClNO4S/c1-6-5-7(9)3-4-8(6,10(11)12)15(2,13)14/h3-6H,1-2H3