2-[(3-nitro-5-sulfamoyl-thiophen-2-yl)sulfanylmethyl]butanedioic acid

Systemtic Name: 2-[(3-nitro-5-sulfamoyl-thiophen-2-yl)sulfanylmethyl]butanedioic acid Openeye Name: 2-[(3-nitro-5-sulfamoyl-2-thienyl)sulfanylmethyl]butanedioic acid CAS Name: 2-[[(3-nitro-5-sulfamoyl-2-thiophenyl)thio]methyl]butanedioic acid IUPAC Name: 2-[(3-nitro-5-sulfamoylthiophen-2-yl)sulfanylmethyl]butanedioic acid Traditional Name: 2-[[(3-nitro-5-sulfamoyl-2-thienyl)thio]methyl]succinic acid Formula: C9H10N2O8S3 MolecularWeight: 370.3793

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1[N+](=O)[O-])SCC(CC(=O)O)C(=O)O)S(=O)(=O)N

Isomeric SMILES

C1=C(SC(=C1[N+](=O)[O-])SCC(CC(=O)O)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C9H10N2O8S3/c10-22(18,19)7-2-5(11(16)17)9(21-7)20-3-4(8(14)15)1-6(12)13/h2,4H,1,3H2,(H,12,13)(H,14,15)(H2,10,18,19)