methyl 2-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonylamino]benzoate

Systemtic Name: methyl 2-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonylamino]benzoate Openeye Name: methyl 2-[(5-bromo-1-propanoyl-indolin-7-yl)sulfonylamino]benzoate CAS Name: 2-[[5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-1-propionyl-indolin-7-yl)sulfonylamino]benzoic acid methyl ester Formula: C19H19BrN2O5S MolecularWeight: 467.33356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NC3=CC=CC=C3C(=O)OC)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NC3=CC=CC=C3C(=O)OC)Br

InChI

InChI=1S/C19H19BrN2O5S/c1-3-17(23)22-9-8-12-10-13(20)11-16(18(12)22)28(25,26)21-15-7-5-4-6-14(15)19(24)27-2/h4-7,10-11,21H,3,8-9H2,1-2H3