ethyl 4-[3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-(1-propanoylindolin-5-yl)sulfonylpropanoylamino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-3-[[1-(1-oxopropyl)-2,3-dihydroindol-5-yl]sulfonyl]propyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate Traditional Name: 4-[3-(1-propionylindolin-5-yl)sulfonylpropanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)NC3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)NC3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H31N3O6S/c1-3-21(27)25-13-7-16-15-18(5-6-19(16)25)32(29,30)14-10-20(26)23-17-8-11-24(12-9-17)22(28)31-4-2/h5-6,15,17H,3-4,7-14H2,1-2H3,(H,23,26)