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

Systemtic Name: 2-[3-oxidanylidene-6-[(4-pentylphenyl)sulfamoyl]-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[3-oxo-6-[(4-pentylphenyl)sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[3-oxo-6-[(4-pentylphenyl)sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[3-oxo-6-[(4-pentylphenyl)sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[6-[(4-amylphenyl)sulfamoyl]-3-keto-1,4-benzoxazin-4-yl]acetic acid Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O

InChI

InChI=1S/C21H24N2O6S/c1-2-3-4-5-15-6-8-16(9-7-15)22-30(27,28)17-10-11-19-18(12-17)23(13-21(25)26)20(24)14-29-19/h6-12,22H,2-5,13-14H2,1H3,(H,25,26)