ethyl (2R,3S)-1-cyclopropylcarbonyl-2-phenyl-3-(phenylcarbonyl)-1,2,3,8a-tetrahydroindolizine-6-carboxylate

Systemtic Name: ethyl (2R,3S)-1-cyclopropylcarbonyl-2-phenyl-3-(phenylcarbonyl)-1,2,3,8a-tetrahydroindolizine-6-carboxylate Openeye Name: ethyl (2R,3S)-3-benzoyl-1-(cyclopropanecarbonyl)-2-phenyl-1,2,3,8a-tetrahydroindolizine-6-carboxylate CAS Name: (2R,3S)-3-benzoyl-1-[cyclopropyl(oxo)methyl]-2-phenyl-1,2,3,8a-tetrahydroindolizine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S)-3-benzoyl-1-(cyclopropanecarbonyl)-2-phenyl-1,2,3,8a-tetrahydroindolizine-6-carboxylate Traditional Name: (2R,3S)-3-benzoyl-1-(cyclopropanecarbonyl)-2-phenyl-1,2,3,8a-tetrahydroindolizine-6-carboxylic acid ethyl ester Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(C=C1)C(C(C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5CC5

Isomeric SMILES

CCOC(=O)C1=CN2[C@@H]([C@H](C(C2C=C1)C(=O)C3CC3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H27NO4/c1-2-33-28(32)21-15-16-22-24(26(30)20-13-14-20)23(18-9-5-3-6-10-18)25(29(22)17-21)27(31)19-11-7-4-8-12-19/h3-12,15-17,20,22-25H,2,13-14H2,1H3/t22?,23-,24?,25-/m0/s1