ethyl 2-[4-(cyclopentylcarbamoyl)-2-nitro-phenyl]sulfonylethanoate

Systemtic Name: ethyl 2-[4-(cyclopentylcarbamoyl)-2-nitro-phenyl]sulfonylethanoate Openeye Name: ethyl 2-[4-(cyclopentylcarbamoyl)-2-nitro-phenyl]sulfonylacetate CAS Name: 2-[4-[(cyclopentylamino)-oxomethyl]-2-nitrophenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[4-(cyclopentylcarbamoyl)-2-nitrophenyl]sulfonylacetate Traditional Name: 2-[4-(cyclopentylcarbamoyl)-2-nitro-phenyl]sulfonylacetic acid ethyl ester Formula: C16H20N2O7S MolecularWeight: 384.4042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NC2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NC2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7S/c1-2-25-15(19)10-26(23,24)14-8-7-11(9-13(14)18(21)22)16(20)17-12-5-3-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,17,20)