methyl (6R)-8-[(E)-2-(3-nitrophenyl)-1-(4-nitrophenyl)ethenyl]-2-oxidanylidene-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate

Systemtic Name: methyl (6R)-8-[(E)-2-(3-nitrophenyl)-1-(4-nitrophenyl)ethenyl]-2-oxidanylidene-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate Openeye Name: methyl (6R)-8-[(E)-2-(3-nitrophenyl)-1-(4-nitrophenyl)vinyl]-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate CAS Name: (6R)-8-[(E)-2-(3-nitrophenyl)-1-(4-nitrophenyl)ethenyl]-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester IUPAC Name: methyl (6R)-8-[(E)-2-(3-nitrophenyl)-1-(4-nitrophenyl)ethenyl]-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate Traditional Name: (6R)-2-keto-8-[(E)-2-(3-nitrophenyl)-1-(4-nitrophenyl)vinyl]-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester Formula: C23H19N3O7 MolecularWeight: 449.41286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2C(=O)C=CC1N2C(=CC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@H]1CC2C(=O)C=CC1N2/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O7/c1-33-23(28)18-13-21-22(27)10-9-19(18)24(21)20(15-5-7-16(8-6-15)25(29)30)12-14-3-2-4-17(11-14)26(31)32/h2-12,18-19,21H,13H2,1H3/b20-12+/t18-,19?,21?/m1/s1