diethyl 3-methyl-5-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[3-nitro-4-(1-piperidyl)benzoyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(3-nitro-4-piperidino-benzoyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O7S/c1-4-32-22(28)18-14(3)19(23(29)33-5-2)34-21(18)24-20(27)15-9-10-16(17(13-15)26(30)31)25-11-7-6-8-12-25/h9-10,13H,4-8,11-12H2,1-3H3,(H,24,27)