tert-butyl 6-oxidanylidene-4-(phenylmethoxycarbonylamino)-7-azabicyclo[3.2.1]octane-7-carboxylate

Systemtic Name: tert-butyl 6-oxidanylidene-4-(phenylmethoxycarbonylamino)-7-azabicyclo[3.2.1]octane-7-carboxylate Openeye Name: tert-butyl 4-(benzyloxycarbonylamino)-6-oxo-7-azabicyclo[3.2.1]octane-7-carboxylate CAS Name: 6-oxo-4-(phenylmethoxycarbonylamino)-7-azabicyclo[3.2.1]octane-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-oxo-4-(phenylmethoxycarbonylamino)-7-azabicyclo[3.2.1]octane-7-carboxylate Traditional Name: 4-(benzyloxycarbonylamino)-6-keto-7-azabicyclo[3.2.1]octane-7-carboxylic acid tert-butyl ester Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2CCC(C(C2)C1=O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C2CCC(C(C2)C1=O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O5/c1-20(2,3)27-19(25)22-14-9-10-16(15(11-14)17(22)23)21-18(24)26-12-13-7-5-4-6-8-13/h4-8,14-16H,9-12H2,1-3H3,(H,21,24)