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

Systemtic Name: tert-butyl 4-[[3-(7-cyanonaphthalen-2-yl)-1-oxidanylidene-1-phenoxy-propan-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[1-[(7-cyano-2-naphthyl)methyl]-2-oxo-2-phenoxy-ethoxy]methyl]piperidine-1-carboxylate CAS Name: 4-[[3-(7-cyano-2-naphthalenyl)-1-oxo-1-phenoxypropan-2-yl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(7-cyanonaphthalen-2-yl)-1-oxo-1-phenoxypropan-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[1-[(7-cyano-2-naphthyl)methyl]-2-keto-2-phenoxy-ethoxy]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C31H34N2O5 MolecularWeight: 514.61206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC(CC2=CC3=C(C=C2)C=CC(=C3)C#N)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC(CC2=CC3=C(C=C2)C=CC(=C3)C#N)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C31H34N2O5/c1-31(2,3)38-30(35)33-15-13-22(14-16-33)21-36-28(29(34)37-27-7-5-4-6-8-27)19-23-9-11-25-12-10-24(20-32)18-26(25)17-23/h4-12,17-18,22,28H,13-16,19,21H2,1-3H3