ethyl (1R,2R,3R,8aS)-3,6-diaminocarbonyl-1-cyano-2-(3-nitrophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate

Systemtic Name: ethyl (1R,2R,3R,8aS)-3,6-diaminocarbonyl-1-cyano-2-(3-nitrophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate Openeye Name: ethyl (1R,2R,3R,8aS)-3,6-dicarbamoyl-1-cyano-2-(3-nitrophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate CAS Name: (1R,2R,3R,8aS)-3,6-dicarbamoyl-1-cyano-2-(3-nitrophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R,3R,8aS)-3,6-dicarbamoyl-1-cyano-2-(3-nitrophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate Traditional Name: (1R,2R,3R,8aS)-3,6-dicarbamoyl-1-cyano-2-(3-nitrophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid ethyl ester Formula: C20H19N5O6 MolecularWeight: 425.39476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2C=CC(=CN2C(C1C3=CC(=CC=C3)[N+](=O)[O-])C(=O)N)C(=O)N)C#N

Isomeric SMILES

CCOC(=O)[C@]1([C@@H]2C=CC(=CN2[C@H]([C@@H]1C3=CC(=CC=C3)[N+](=O)[O-])C(=O)N)C(=O)N)C#N

InChI

InChI=1S/C20H19N5O6/c1-2-31-19(28)20(10-21)14-7-6-12(17(22)26)9-24(14)16(18(23)27)15(20)11-4-3-5-13(8-11)25(29)30/h3-9,14-16H,2H2,1H3,(H2,22,26)(H2,23,27)/t14-,15-,16+,20-/m0/s1