ethyl 2-(2-nitro-4-piperidin-1-ylcarbonyl-phenyl)sulfonylethanoate

Systemtic Name: ethyl 2-(2-nitro-4-piperidin-1-ylcarbonyl-phenyl)sulfonylethanoate Openeye Name: ethyl 2-[2-nitro-4-(piperidine-1-carbonyl)phenyl]sulfonylacetate CAS Name: 2-[2-nitro-4-[oxo(1-piperidinyl)methyl]phenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-nitro-4-(piperidine-1-carbonyl)phenyl]sulfonylacetate Traditional Name: 2-[2-nitro-4-(piperidine-1-carbonyl)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)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7S/c1-2-25-15(19)11-26(23,24)14-7-6-12(10-13(14)18(21)22)16(20)17-8-4-3-5-9-17/h6-7,10H,2-5,8-9,11H2,1H3