O3-ethyl O5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; 2-methyl-1,2-oxaziridin-3-one

Systemtic Name: O3-ethyl O5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; 2-methyl-1,2-oxaziridin-3-one Openeye Name: O3-ethyl O5-isopropyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; 2-methyloxaziridin-3-one CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-propan-2-yl ester; 2-methyl-3-oxaziridinone IUPAC Name: 3-O-ethyl 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; 2-methyloxaziridin-3-one Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-isopropyl ester; 2-methyloxaziridin-3-one Formula: C22H27N3O8 MolecularWeight: 461.46508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)C)C.CN1C(=O)O1

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)C)C.CN1C(=O)O1

InChI

InChI=1S/C20H24N2O6.C2H3NO2/c1-6-27-19(23)16-12(4)21-13(5)17(20(24)28-11(2)3)18(16)14-8-7-9-15(10-14)22(25)26;1-3-2(4)5-3/h7-11,18,21H,6H2,1-5H3;1H3