ethyl 2-[4-(butan-2-ylcarbamoyl)-2-nitro-phenyl]sulfonylethanoate

Systemtic Name: ethyl 2-[4-(butan-2-ylcarbamoyl)-2-nitro-phenyl]sulfonylethanoate Openeye Name: ethyl 2-[2-nitro-4-(sec-butylcarbamoyl)phenyl]sulfonylacetate CAS Name: 2-[4-[(butan-2-ylamino)-oxomethyl]-2-nitrophenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[4-(butan-2-ylcarbamoyl)-2-nitrophenyl]sulfonylacetate Traditional Name: 2-[2-nitro-4-(sec-butylcarbamoyl)phenyl]sulfonylacetic acid ethyl ester Formula: C15H20N2O7S MolecularWeight: 372.3935

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=C(C=C1)S(=O)(=O)CC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=C(C=C1)S(=O)(=O)CC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O7S/c1-4-10(3)16-15(19)11-6-7-13(12(8-11)17(20)21)25(22,23)9-14(18)24-5-2/h6-8,10H,4-5,9H2,1-3H3,(H,16,19)