ethyl 4-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonylamino]benzoate

Systemtic Name: ethyl 4-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonylamino]benzoate Openeye Name: ethyl 4-[[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonylamino]benzoate CAS Name: 4-[[5-bromo-1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-7-yl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydroindol-7-yl]sulfonylamino]benzoate Traditional Name: 4-[[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonylamino]benzoic acid ethyl ester Formula: C21H21BrN2O5S MolecularWeight: 493.37084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4

InChI

InChI=1S/C21H21BrN2O5S/c1-2-29-21(26)14-5-7-17(8-6-14)23-30(27,28)18-12-16(22)11-15-9-10-24(19(15)18)20(25)13-3-4-13/h5-8,11-13,23H,2-4,9-10H2,1H3