ethyl (4aS,7aR)-1-oxidanylidene-3-phenyl-2,4a,5,7a-tetrahydrocyclopenta[c]pyridine-4-carboxylate

Systemtic Name: ethyl (4aS,7aR)-1-oxidanylidene-3-phenyl-2,4a,5,7a-tetrahydrocyclopenta[c]pyridine-4-carboxylate Openeye Name: ethyl (4aS,7aR)-1-oxo-3-phenyl-2,4a,5,7a-tetrahydrocyclopenta[c]pyridine-4-carboxylate CAS Name: (4aS,7aR)-1-oxo-3-phenyl-2,4a,5,7a-tetrahydrocyclopenta[c]pyridine-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4aS,7aR)-1-oxo-3-phenyl-2,4a,5,7a-tetrahydrocyclopenta[c]pyridine-4-carboxylate Traditional Name: (4aS,7aR)-1-keto-3-phenyl-2,4a,5,7a-tetrahydro-2-pyrindine-4-carboxylic acid ethyl ester Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C2C1CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)[C@H]2[C@@H]1CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H17NO3/c1-2-21-17(20)14-12-9-6-10-13(12)16(19)18-15(14)11-7-4-3-5-8-11/h3-8,10,12-13H,2,9H2,1H3,(H,18,19)/t12-,13+/m0/s1