tert-butyl 4-[[4-[3-(7-cyanonaphthalen-2-yl)-1-ethoxy-1-oxidanylidene-propan-2-yl]phenoxy]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[3-(7-cyanonaphthalen-2-yl)-1-ethoxy-1-oxidanylidene-propan-2-yl]phenoxy]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[1-[(7-cyano-2-naphthyl)methyl]-2-ethoxy-2-oxo-ethyl]phenoxy]methyl]piperidine-1-carboxylate CAS Name: 4-[[4-[3-(7-cyano-2-naphthalenyl)-1-ethoxy-1-oxopropan-2-yl]phenoxy]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[3-(7-cyanonaphthalen-2-yl)-1-ethoxy-1-oxopropan-2-yl]phenoxy]methyl]piperidine-1-carboxylate Traditional Name: 4-[[4-[1-[(7-cyano-2-naphthyl)methyl]-2-ethoxy-2-keto-ethyl]phenoxy]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C33H38N2O5 MolecularWeight: 542.66522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1)C=CC(=C2)C#N)C3=CC=C(C=C3)OCC4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1)C=CC(=C2)C#N)C3=CC=C(C=C3)OCC4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C33H38N2O5/c1-5-38-31(36)30(20-24-6-8-26-9-7-25(21-34)19-28(26)18-24)27-10-12-29(13-11-27)39-22-23-14-16-35(17-15-23)32(37)40-33(2,3)4/h6-13,18-19,23,30H,5,14-17,20,22H2,1-4H3