methyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C13H11ClN2O6S2 MolecularWeight: 390.81924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H11ClN2O6S2/c1-7-5-11(23-12(7)13(17)22-2)15-24(20,21)8-3-4-9(14)10(6-8)16(18)19/h3-6,15H,1-2H3