4-(2-ethylbutanoylamino)-3-nitro-benzenesulfonyl chloride

Systemtic Name: 4-(2-ethylbutanoylamino)-3-nitro-benzenesulfonyl chloride Openeye Name: 4-(2-ethylbutanoylamino)-3-nitro-benzenesulfonyl chloride CAS Name: 4-[(2-ethyl-1-oxobutyl)amino]-3-nitrobenzenesulfonyl chloride IUPAC Name: 4-(2-ethylbutanoylamino)-3-nitrobenzenesulfonyl chloride Traditional Name: 4-(2-ethylbutanoylamino)-3-nitro-benzenesulfonyl chloride Formula: C12H15ClN2O5S MolecularWeight: 334.7759

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN2O5S/c1-3-8(4-2)12(16)14-10-6-5-9(21(13,19)20)7-11(10)15(17)18/h5-8H,3-4H2,1-2H3,(H,14,16)