4-chloranyl-2-nitro-5-octadecylsulfonyl-benzoyl chloride

Systemtic Name: 4-chloranyl-2-nitro-5-octadecylsulfonyl-benzoyl chloride Openeye Name: 4-chloro-2-nitro-5-octadecylsulfonyl-benzoyl chloride CAS Name: 4-chloro-2-nitro-5-octadecylsulfonylbenzoyl chloride IUPAC Name: 4-chloro-2-nitro-5-octadecylsulfonylbenzoyl chloride Traditional Name: 4-chloro-2-nitro-5-stearylsulfonyl-benzoyl chloride Formula: C25H39Cl2NO5S MolecularWeight: 536.55186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H39Cl2NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-34(32,33)24-19-21(25(27)29)23(28(30)31)20-22(24)26/h19-20H,2-18H2,1H3