2,2-dimethylpropanoyloxymethyl (4R)-5-bromanyl-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl (4R)-5-bromanyl-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: 2,2-dimethylpropanoyloxymethyl (4R)-5-bromo-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: (4R)-5-bromo-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl (4R)-5-bromo-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: (4R)-5-bromo-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid pivaloyloxymethyl ester Formula: C22H27BrN2O7 MolecularWeight: 511.36298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1COC)C)Br)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCOC(=O)C(C)(C)C

Isomeric SMILES

CC1=C([C@H](C(=C(N1COC)C)Br)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCOC(=O)C(C)(C)C

InChI

InChI=1S/C22H27BrN2O7/c1-13-17(20(26)31-12-32-21(27)22(3,4)5)18(19(23)14(2)24(13)11-30-6)15-8-7-9-16(10-15)25(28)29/h7-10,18H,11-12H2,1-6H3/t18-/m1/s1