tert-butyl 4-(4-methoxyphenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-methoxyphenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-methoxyphenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-(2-oxo-1H-imidazol-3-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-methoxyphenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate Traditional Name: 2-(2-keto-4-imidazolin-1-yl)-4-(4-methoxyphenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H27N3O4/c1-20(2,3)27-19(25)23-11-9-15(14-5-7-16(26-4)8-6-14)13-17(23)22-12-10-21-18(22)24/h5-8,10,12,15,17H,9,11,13H2,1-4H3,(H,21,24)