sodium 6-azanyl-4-chloranyl-6-(furan-2-ylmethyl)-3-sulfamoyl-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: sodium 6-azanyl-4-chloranyl-6-(furan-2-ylmethyl)-3-sulfamoyl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: sodium 6-amino-4-chloro-6-(2-furylmethyl)-3-sulfamoyl-cyclohexa-2,4-diene-1-carboxylate CAS Name: sodium 6-amino-4-chloro-6-(2-furanylmethyl)-3-sulfamoyl-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: sodium 6-amino-4-chloro-6-(furan-2-ylmethyl)-3-sulfamoylcyclohexa-2,4-diene-1-carboxylate Traditional Name: sodium 6-amino-4-chloro-6-(2-furfuryl)-3-sulfamoyl-cyclohexa-2,4-diene-1-carboxylate Formula: C12H12ClN2NaO5S MolecularWeight: 354.74185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CC2(C=C(C(=CC2C(=O)[O-])S(=O)(=O)N)Cl)N.[Na+]

Isomeric SMILES

C1=COC(=C1)CC2(C=C(C(=CC2C(=O)[O-])S(=O)(=O)N)Cl)N.[Na+]

InChI

InChI=1S/C12H13ClN2O5S.Na/c13-9-6-12(14,5-7-2-1-3-20-7)8(11(16)17)4-10(9)21(15,18)19;/h1-4,6,8H,5,14H2,(H,16,17)(H2,15,18,19);/q;+1/p-1