tert-butyl 4-[4-[3-(6-cyano-1-ethyl-indol-2-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[3-(6-cyano-1-ethyl-indol-2-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[1-[(6-cyano-1-ethyl-indol-2-yl)methyl]-2-methoxy-2-oxo-ethyl]phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-[3-(6-cyano-1-ethyl-2-indolyl)-1-methoxy-1-oxopropan-2-yl]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[3-(6-cyano-1-ethylindol-2-yl)-1-methoxy-1-oxopropan-2-yl]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[1-[(6-cyano-1-ethyl-indol-2-yl)methyl]-2-keto-2-methoxy-ethyl]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C31H37N3O5 MolecularWeight: 531.64258

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C#N)CC(C3=CC=C(C=C3)OC4CCN(CC4)C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C#N)CC(C3=CC=C(C=C3)OC4CCN(CC4)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C31H37N3O5/c1-6-34-24(18-23-8-7-21(20-32)17-28(23)34)19-27(29(35)37-5)22-9-11-25(12-10-22)38-26-13-15-33(16-14-26)30(36)39-31(2,3)4/h7-12,17-18,26-27H,6,13-16,19H2,1-5H3