methyl 3-(2,4-dinitrophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl 3-(2,4-dinitrophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl 3-(2,4-dinitrophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 3-(2,4-dinitrophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(2,4-dinitrophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 3-(2,4-dinitrophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN1C2CCC1C(C(C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H19N3O6/c1-17-9-4-6-13(17)15(16(20)25-2)12(7-9)11-5-3-10(18(21)22)8-14(11)19(23)24/h3,5,8-9,12-13,15H,4,6-7H2,1-2H3