3-nitro-5-propanoyl-benzenesulfonyl chloride

Systemtic Name: 3-nitro-5-propanoyl-benzenesulfonyl chloride Openeye Name: 3-nitro-5-propanoyl-benzenesulfonyl chloride CAS Name: 3-nitro-5-(1-oxopropyl)benzenesulfonyl chloride IUPAC Name: 3-nitro-5-propanoylbenzenesulfonyl chloride Traditional Name: 3-nitro-5-propionyl-benzenesulfonyl chloride Formula: C9H8ClNO5S MolecularWeight: 277.68152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC(=C1)S(=O)(=O)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC(=CC(=C1)S(=O)(=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H8ClNO5S/c1-2-9(12)6-3-7(11(13)14)5-8(4-6)17(10,15)16/h3-5H,2H2,1H3