propan-2-yl 4-(4-iodanylpyrazol-1-yl)piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-(4-iodanylpyrazol-1-yl)piperidine-1-carboxylate Openeye Name: isopropyl 4-(4-iodopyrazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(4-iodo-1-pyrazolyl)-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-iodopyrazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-iodopyrazol-1-yl)piperidine-1-carboxylic acid isopropyl ester Formula: C12H18IN3O2 MolecularWeight: 363.19469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)N2C=C(C=N2)I

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)N2C=C(C=N2)I

InChI

InChI=1S/C12H18IN3O2/c1-9(2)18-12(17)15-5-3-11(4-6-15)16-8-10(13)7-14-16/h7-9,11H,3-6H2,1-2H3