tert-butyl 6-oxidanylidene-8-phenyl-5,7,8,9-tetrahydro-4H-cycloocta[b]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 6-oxidanylidene-8-phenyl-5,7,8,9-tetrahydro-4H-cycloocta[b]pyrrole-1-carboxylate Openeye Name: tert-butyl 6-oxo-8-phenyl-5,7,8,9-tetrahydro-4H-cycloocta[b]pyrrole-1-carboxylate CAS Name: 6-oxo-8-phenyl-5,7,8,9-tetrahydro-4H-cycloocta[b]pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-oxo-8-phenyl-5,7,8,9-tetrahydro-4H-cycloocta[b]pyrrole-1-carboxylate Traditional Name: 6-keto-8-phenyl-5,7,8,9-tetrahydro-4H-cycloocta[b]pyrrole-1-carboxylic acid tert-butyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C1CC(CC(=O)CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C1CC(CC(=O)CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO3/c1-21(2,3)25-20(24)22-12-11-16-9-10-18(23)13-17(14-19(16)22)15-7-5-4-6-8-15/h4-8,11-12,17H,9-10,13-14H2,1-3H3