methyl 5-bromanyl-2-(2,3-dihydro-1H-inden-5-ylsulfonylamino)benzoate

Systemtic Name: methyl 5-bromanyl-2-(2,3-dihydro-1H-inden-5-ylsulfonylamino)benzoate Openeye Name: methyl 5-bromo-2-(indan-5-ylsulfonylamino)benzoate CAS Name: 5-bromo-2-(2,3-dihydro-1H-inden-5-ylsulfonylamino)benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(2,3-dihydro-1H-inden-5-ylsulfonylamino)benzoate Traditional Name: 5-bromo-2-(indan-5-ylsulfonylamino)benzoic acid methyl ester Formula: C17H16BrNO4S MolecularWeight: 410.28224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C17H16BrNO4S/c1-23-17(20)15-10-13(18)6-8-16(15)19-24(21,22)14-7-5-11-3-2-4-12(11)9-14/h5-10,19H,2-4H2,1H3