ethyl 2-[4-[2-(4-chlorophenyl)ethylcarbamoyl]-2-nitro-phenyl]sulfonylethanoate

Systemtic Name: ethyl 2-[4-[2-(4-chlorophenyl)ethylcarbamoyl]-2-nitro-phenyl]sulfonylethanoate Openeye Name: ethyl 2-[4-[2-(4-chlorophenyl)ethylcarbamoyl]-2-nitro-phenyl]sulfonylacetate CAS Name: 2-[4-[[2-(4-chlorophenyl)ethylamino]-oxomethyl]-2-nitrophenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-(4-chlorophenyl)ethylcarbamoyl]-2-nitrophenyl]sulfonylacetate Traditional Name: 2-[4-[2-(4-chlorophenyl)ethylcarbamoyl]-2-nitro-phenyl]sulfonylacetic acid ethyl ester Formula: C19H19ClN2O7S MolecularWeight: 454.88136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NCCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NCCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O7S/c1-2-29-18(23)12-30(27,28)17-8-5-14(11-16(17)22(25)26)19(24)21-10-9-13-3-6-15(20)7-4-13/h3-8,11H,2,9-10,12H2,1H3,(H,21,24)