methyl 1-[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(3-indolin-1-ylsulfonylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-(3-indolin-1-ylsulfonylbenzoyl)isonipecotic acid methyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H24N2O5S/c1-29-22(26)17-9-12-23(13-10-17)21(25)18-6-4-7-19(15-18)30(27,28)24-14-11-16-5-2-3-8-20(16)24/h2-8,15,17H,9-14H2,1H3