tert-butyl 3-[bis(phenylmethyl)amino]-3-cyano-azetidine-1-carboxylate

Systemtic Name: tert-butyl 3-[bis(phenylmethyl)amino]-3-cyano-azetidine-1-carboxylate Openeye Name: tert-butyl 3-cyano-3-(dibenzylamino)azetidine-1-carboxylate CAS Name: 3-[bis(phenylmethyl)amino]-3-cyano-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-cyano-3-(dibenzylamino)azetidine-1-carboxylate Traditional Name: 3-cyano-3-(dibenzylamino)azetidine-1-carboxylic acid tert-butyl ester Formula: C23H27N3O2 MolecularWeight: 377.47938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C1)(C#N)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C1)(C#N)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O2/c1-22(2,3)28-21(27)25-17-23(16-24,18-25)26(14-19-10-6-4-7-11-19)15-20-12-8-5-9-13-20/h4-13H,14-15,17-18H2,1-3H3