(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 3-[(4-fluorophenyl)sulfonylamino]-4-methyl-benzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 3-[(4-fluorophenyl)sulfonylamino]-4-methyl-benzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 3-[(4-fluorophenyl)sulfonylamino]-4-methyl-benzoate CAS Name: 3-[(4-fluorophenyl)sulfonylamino]-4-methylbenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 3-[(4-fluorophenyl)sulfonylamino]-4-methylbenzoate Traditional Name: 3-[(4-fluorophenyl)sulfonylamino]-4-methyl-benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C23H19ClFNO6S MolecularWeight: 491.916463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H19ClFNO6S/c1-14-2-3-15(10-21(14)26-33(28,29)20-6-4-19(25)5-7-20)23(27)31-12-17-9-18(24)8-16-11-30-13-32-22(16)17/h2-10,26H,11-13H2,1H3