2-[6-[(4-ethoxy-3-sulfamoyl-phenyl)sulfamoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoic acid

Systemtic Name: 2-[6-[(4-ethoxy-3-sulfamoyl-phenyl)sulfamoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[6-[(4-ethoxy-3-sulfamoyl-phenyl)sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[6-[(4-ethoxy-3-sulfamoylphenyl)sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[6-[(4-ethoxy-3-sulfamoylphenyl)sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[6-[(4-ethoxy-3-sulfamoyl-phenyl)sulfamoyl]-3-keto-1,4-benzoxazin-4-yl]acetic acid Formula: C18H19N3O9S2 MolecularWeight: 485.48816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O)S(=O)(=O)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O)S(=O)(=O)N

InChI

InChI=1S/C18H19N3O9S2/c1-2-29-15-5-3-11(7-16(15)31(19,25)26)20-32(27,28)12-4-6-14-13(8-12)21(9-18(23)24)17(22)10-30-14/h3-8,20H,2,9-10H2,1H3,(H,23,24)(H2,19,25,26)