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

Systemtic Name: 2-cyclohexyl-1,2-oxaziridin-3-one; O3-ethyl O5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: 2-cyclohexyloxaziridin-3-one; O3-ethyl O5-isopropyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-cyclohexyl-3-oxaziridinone; 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-propan-2-yl ester IUPAC Name: 2-cyclohexyloxaziridin-3-one; 3-O-ethyl 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-cyclohexyloxaziridin-3-one; 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-isopropyl ester Formula: C27H35N3O8 MolecularWeight: 529.5821

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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.C1CCC(CC1)N2C(=O)O2

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)C)C.C1CCC(CC1)N2C(=O)O2

InChI

InChI=1S/C20H24N2O6.C7H11NO2/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;9-7-8(10-7)6-4-2-1-3-5-6/h7-11,18,21H,6H2,1-5H3;6H,1-5H2