ethyl 4-[3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonylpropanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[[5-bromo-1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-7-yl]sulfonyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydroindol-7-yl]sulfonyl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonylpropanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H28BrN3O6S MolecularWeight: 542.44322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4

InChI

InChI=1S/C22H28BrN3O6S/c1-2-32-22(29)25-10-8-24(9-11-25)19(27)6-12-33(30,31)18-14-17(23)13-16-5-7-26(20(16)18)21(28)15-3-4-15/h13-15H,2-12H2,1H3