tert-butyl 5-[(2-bromanylpyridin-3-yl)-[(2-methylpropan-2-yl)oxycarbonyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 5-[(2-bromanylpyridin-3-yl)-[(2-methylpropan-2-yl)oxycarbonyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 5-[(2-bromo-3-pyridyl)-tert-butoxycarbonyl-carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[[(2-bromo-3-pyridinyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-oxomethyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(2-bromopyridin-3-yl)-[(2-methylpropan-2-yl)oxycarbonyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[(2-bromo-3-pyridyl)-tert-butoxycarbonyl-carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C21H28BrN3O5 MolecularWeight: 482.36812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC=C(C1)C(=O)N(C2=C(N=CC=C2)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC=C(C1)C(=O)N(C2=C(N=CC=C2)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H28BrN3O5/c1-20(2,3)29-18(27)24-12-8-9-14(13-24)17(26)25(19(28)30-21(4,5)6)15-10-7-11-23-16(15)22/h7,9-11H,8,12-13H2,1-6H3