methyl 4-[2-(methoxycarbonylamino)ethyl]-2-sulfamoyl-benzoate

Systemtic Name: methyl 4-[2-(methoxycarbonylamino)ethyl]-2-sulfamoyl-benzoate Openeye Name: methyl 4-[2-(methoxycarbonylamino)ethyl]-2-sulfamoyl-benzoate CAS Name: 4-[2-(methoxycarbonylamino)ethyl]-2-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-[2-(methoxycarbonylamino)ethyl]-2-sulfamoylbenzoate Traditional Name: 4-[2-(carbomethoxyamino)ethyl]-2-sulfamoyl-benzoic acid methyl ester Formula: C12H16N2O6S MolecularWeight: 316.33024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)CCNC(=O)OC)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)CCNC(=O)OC)S(=O)(=O)N

InChI

InChI=1S/C12H16N2O6S/c1-19-11(15)9-4-3-8(5-6-14-12(16)20-2)7-10(9)21(13,17)18/h3-4,7H,5-6H2,1-2H3,(H,14,16)(H2,13,17,18)