[(2R)-1-[bis(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [(2R)-1-[bis(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [(1R)-2-(dibenzylamino)-1-methyl-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [(2R)-1-[bis(phenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(dibenzylamino)-1-oxopropan-2-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [(1R)-2-(dibenzylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H21BrN2O3 MolecularWeight: 453.32844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)OC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C[C@H](C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)OC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C23H21BrN2O3/c1-17(29-23(28)20-12-21(24)14-25-13-20)22(27)26(15-18-8-4-2-5-9-18)16-19-10-6-3-7-11-19/h2-14,17H,15-16H2,1H3/t17-/m1/s1