tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(7-cyano-2-naphthyl)-1-ethylsulfonyl-indolin-5-yl]methyl]piperidine-1-carboxylate CAS Name: 4-[[2-(7-cyano-2-naphthalenyl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]methyl]piperidine-1-carboxylate Traditional Name: 4-[[2-(7-cyano-2-naphthyl)-1-esyl-indolin-5-yl]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H37N3O4S MolecularWeight: 559.71888

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)CC3CCN(CC3)C(=O)OC(C)(C)C)C4=CC5=C(C=CC(=C5)C#N)C=C4

Isomeric SMILES

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)CC3CCN(CC3)C(=O)OC(C)(C)C)C4=CC5=C(C=CC(=C5)C#N)C=C4

InChI

InChI=1S/C32H37N3O4S/c1-5-40(37,38)35-29-11-7-23(16-22-12-14-34(15-13-22)31(36)39-32(2,3)4)17-28(29)20-30(35)26-10-9-25-8-6-24(21-33)18-27(25)19-26/h6-11,17-19,22,30H,5,12-16,20H2,1-4H3