(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-[(4-methoxyphenyl)sulfonylamino]benzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-[(4-methoxyphenyl)sulfonylamino]benzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-[(4-methoxyphenyl)sulfonylamino]benzoate CAS Name: 2-[(4-methoxyphenyl)sulfonylamino]benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-[(4-methoxyphenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-methoxyphenyl)sulfonylamino]benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C23H20ClNO7S MolecularWeight: 489.9254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C23H20ClNO7S/c1-29-18-6-8-19(9-7-18)33(27,28)25-21-5-3-2-4-20(21)23(26)31-13-16-11-17(24)10-15-12-30-14-32-22(15)16/h2-11,25H,12-14H2,1H3