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

Systemtic Name: ethyl (1S,2R,3R,8aS)-3-aminocarbonyl-1-cyano-6-ethanoyl-2-(2-methoxyphenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate Openeye Name: ethyl (1S,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-methoxyphenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate CAS Name: (1S,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-methoxyphenyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-methoxyphenyl)-3,8a-dihydro-2H-indolizine-1-carboxylate Traditional Name: (1S,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-methoxyphenyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid ethyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2C=CC(=CN2C(C1C3=CC=CC=C3OC)C(=O)N)C(=O)C)C#N

Isomeric SMILES

CCOC(=O)[C@@]1([C@@H]2C=CC(=CN2[C@H]([C@@H]1C3=CC=CC=C3OC)C(=O)N)C(=O)C)C#N

InChI

InChI=1S/C22H23N3O5/c1-4-30-21(28)22(12-23)17-10-9-14(13(2)26)11-25(17)19(20(24)27)18(22)15-7-5-6-8-16(15)29-3/h5-11,17-19H,4H2,1-3H3,(H2,24,27)/t17-,18-,19+,22+/m0/s1