tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-(6-ethoxy-6-oxidanylidene-hexyl)sulfonyl-2,3-dihydroindol-5-yl]oxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-(6-ethoxy-6-oxidanylidene-hexyl)sulfonyl-2,3-dihydroindol-5-yl]oxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(7-cyano-2-naphthyl)-1-(6-ethoxy-6-oxo-hexyl)sulfonyl-indolin-5-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[2-(7-cyano-2-naphthalenyl)-1-(6-ethoxy-6-oxohexyl)sulfonyl-2,3-dihydroindol-5-yl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-(6-ethoxy-6-oxohexyl)sulfonyl-2,3-dihydroindol-5-yl]oxy]piperidine-1-carboxylate Traditional Name: 4-[2-(7-cyano-2-naphthyl)-1-(6-ethoxy-6-keto-hexyl)sulfonyl-indolin-5-yl]oxypiperidine-1-carboxylic acid tert-butyl ester Formula: C37H45N3O7S MolecularWeight: 675.8341

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCN(CC3)C(=O)OC(C)(C)C)C4=CC5=C(C=CC(=C5)C#N)C=C4

Isomeric SMILES

CCOC(=O)CCCCCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCN(CC3)C(=O)OC(C)(C)C)C4=CC5=C(C=CC(=C5)C#N)C=C4

InChI

InChI=1S/C37H45N3O7S/c1-5-45-35(41)9-7-6-8-20-48(43,44)40-33-15-14-32(46-31-16-18-39(19-17-31)36(42)47-37(2,3)4)23-30(33)24-34(40)28-13-12-27-11-10-26(25-38)21-29(27)22-28/h10-15,21-23,31,34H,5-9,16-20,24H2,1-4H3