3-butanoyl-5-nitro-benzenesulfonyl chloride

Systemtic Name: 3-butanoyl-5-nitro-benzenesulfonyl chloride Openeye Name: 3-butanoyl-5-nitro-benzenesulfonyl chloride CAS Name: 3-nitro-5-(1-oxobutyl)benzenesulfonyl chloride IUPAC Name: 3-butanoyl-5-nitrobenzenesulfonyl chloride Traditional Name: 3-butyryl-5-nitro-benzenesulfonyl chloride Formula: C10H10ClNO5S MolecularWeight: 291.7081

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClNO5S/c1-2-3-10(13)7-4-8(12(14)15)6-9(5-7)18(11,16)17/h4-6H,2-3H2,1H3