ethyl (1R,2R,3R,8aS)-6-aminocarbonyl-1-cyano-3-ethanoyl-2-pyridin-3-yl-3,8a-dihydro-2H-indolizine-1-carboxylate

Systemtic Name: ethyl (1R,2R,3R,8aS)-6-aminocarbonyl-1-cyano-3-ethanoyl-2-pyridin-3-yl-3,8a-dihydro-2H-indolizine-1-carboxylate Openeye Name: ethyl (1R,2R,3R,8aS)-3-acetyl-6-carbamoyl-1-cyano-2-(3-pyridyl)-3,8a-dihydro-2H-indolizine-1-carboxylate CAS Name: (1R,2R,3R,8aS)-3-acetyl-6-carbamoyl-1-cyano-2-(3-pyridinyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R,3R,8aS)-3-acetyl-6-carbamoyl-1-cyano-2-pyridin-3-yl-3,8a-dihydro-2H-indolizine-1-carboxylate Traditional Name: (1R,2R,3R,8aS)-3-acetyl-6-carbamoyl-1-cyano-2-(3-pyridyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid ethyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2C=CC(=CN2C(C1C3=CN=CC=C3)C(=O)C)C(=O)N)C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O4/c1-3-28-19(27)20(11-21)15-7-6-14(18(22)26)10-24(15)17(12(2)25)16(20)13-5-4-8-23-9-13/h4-10,15-17H,3H2,1-2H3,(H2,22,26)/t15-,16-,17-,20-/m0/s1