ethyl 2-[[1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-2-yl]carbonylamino]-5-nitro-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-2-yl]carbonylamino]-5-nitro-thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-[(5-chloro-2-thienyl)sulfonyl]piperidine-2-carbonyl]amino]-5-nitro-thiophene-3-carboxylate CAS Name: 2-[[[1-[(5-chloro-2-thiophenyl)sulfonyl]-2-piperidinyl]-oxomethyl]amino]-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(5-chlorothiophen-2-yl)sulfonylpiperidine-2-carbonyl]amino]-5-nitrothiophene-3-carboxylate Traditional Name: 2-[[1-[(5-chloro-2-thienyl)sulfonyl]pipecoloyl]amino]-5-nitro-thiophene-3-carboxylic acid ethyl ester Formula: C17H18ClN3O7S3 MolecularWeight: 507.98872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN3O7S3/c1-2-28-17(23)10-9-13(21(24)25)30-16(10)19-15(22)11-5-3-4-8-20(11)31(26,27)14-7-6-12(18)29-14/h6-7,9,11H,2-5,8H2,1H3,(H,19,22)