4-cyclopropylsulfonyl-2-ethyl-5-nitro-benzoyl chloride

Systemtic Name: 4-cyclopropylsulfonyl-2-ethyl-5-nitro-benzoyl chloride Openeye Name: 4-cyclopropylsulfonyl-2-ethyl-5-nitro-benzoyl chloride CAS Name: 4-cyclopropylsulfonyl-2-ethyl-5-nitrobenzoyl chloride IUPAC Name: 4-cyclopropylsulfonyl-2-ethyl-5-nitrobenzoyl chloride Traditional Name: 4-cyclopropylsulfonyl-2-ethyl-5-nitro-benzoyl chloride Formula: C12H12ClNO5S MolecularWeight: 317.74538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)Cl)[N+](=O)[O-])S(=O)(=O)C2CC2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)Cl)[N+](=O)[O-])S(=O)(=O)C2CC2

InChI

InChI=1S/C12H12ClNO5S/c1-2-7-5-11(20(18,19)8-3-4-8)10(14(16)17)6-9(7)12(13)15/h5-6,8H,2-4H2,1H3