tert-butyl 4-[[(4-cyano-3-naphthalen-1-yl-phenyl)-pyridin-3-yl-methyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(4-cyano-3-naphthalen-1-yl-phenyl)-pyridin-3-yl-methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[4-cyano-3-(1-naphthyl)phenyl]-(3-pyridyl)methyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-cyano-3-(1-naphthalenyl)phenyl]-(3-pyridinyl)methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(4-cyano-3-naphthalen-1-ylphenyl)-pyridin-3-ylmethyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[[4-cyano-3-(1-naphthyl)phenyl]-(3-pyridyl)methyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C33H34N4O2 MolecularWeight: 518.64866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC(C2=CC(=C(C=C2)C#N)C3=CC=CC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC(C2=CC(=C(C=C2)C#N)C3=CC=CC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C33H34N4O2/c1-33(2,3)39-32(38)37-18-15-27(16-19-37)36-31(26-10-7-17-35-22-26)24-13-14-25(21-34)30(20-24)29-12-6-9-23-8-4-5-11-28(23)29/h4-14,17,20,22,27,31,36H,15-16,18-19H2,1-3H3