tert-butyl (5R,6R)-7-oxidanylidene-3-phenyl-6-(2-phenylethanoylamino)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: tert-butyl (5R,6R)-7-oxidanylidene-3-phenyl-6-(2-phenylethanoylamino)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: tert-butyl (5R,6R)-7-oxo-3-phenyl-6-[(2-phenylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: (5R,6R)-7-oxo-6-[(1-oxo-2-phenylethyl)amino]-3-phenyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (5R,6R)-7-oxo-3-phenyl-6-[(2-phenylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: (5R,6R)-7-keto-3-phenyl-6-[(2-phenylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid tert-butyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(CC2N1C(=O)C2NC(=O)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C[C@H]2N1C(=O)[C@@H]2NC(=O)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O4/c1-25(2,3)31-24(30)22-18(17-12-8-5-9-13-17)15-19-21(23(29)27(19)22)26-20(28)14-16-10-6-4-7-11-16/h4-13,19,21H,14-15H2,1-3H3,(H,26,28)/t19-,21-/m1/s1