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

Systemtic Name: 2-[6-[(3-cyanophenyl)sulfamoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[6-[(3-cyanophenyl)sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[6-[(3-cyanophenyl)sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[6-[(3-cyanophenyl)sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[6-[(3-cyanophenyl)sulfamoyl]-3-keto-1,4-benzoxazin-4-yl]acetic acid Formula: C17H13N3O6S MolecularWeight: 387.36662

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC(=C3)C#N)CC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC(=C3)C#N)CC(=O)O

InChI

InChI=1S/C17H13N3O6S/c18-8-11-2-1-3-12(6-11)19-27(24,25)13-4-5-15-14(7-13)20(9-17(22)23)16(21)10-26-15/h1-7,19H,9-10H2,(H,22,23)