ethyl 1-[(1-cyclopropylcarbonyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(1-cyclopropylcarbonyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[1-(cyclopropanecarbonyl)-2-methyl-indolin-5-yl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[[1-[cyclopropyl(oxo)methyl]-2-methyl-2,3-dihydroindol-5-yl]sulfonyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydroindol-5-yl]sulfonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(cyclopropanecarbonyl)-2-methyl-indolin-5-yl]sulfonylnipecotic acid ethyl ester Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(C3)C)C(=O)C4CC4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(C3)C)C(=O)C4CC4

InChI

InChI=1S/C21H28N2O5S/c1-3-28-21(25)16-5-4-10-22(13-16)29(26,27)18-8-9-19-17(12-18)11-14(2)23(19)20(24)15-6-7-15/h8-9,12,14-16H,3-7,10-11,13H2,1-2H3