dimethyl 5-[3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonylpropanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-[[5-bromo-1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-7-yl]sulfonyl]-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydroindol-7-yl]sulfonyl]propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonylpropanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H25BrN2O8S MolecularWeight: 593.4436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4)C(=O)OC

InChI

InChI=1S/C25H25BrN2O8S/c1-35-24(31)16-9-17(25(32)36-2)12-19(11-16)27-21(29)6-8-37(33,34)20-13-18(26)10-15-5-7-28(22(15)20)23(30)14-3-4-14/h9-14H,3-8H2,1-2H3,(H,27,29)