ethyl 2-oxidanyl-2-phenyl-4-(phenylcarbonyl)-1,7-diazabicyclo[4.1.0]hept-5-ene-5-carboxylate

Systemtic Name: ethyl 2-oxidanyl-2-phenyl-4-(phenylcarbonyl)-1,7-diazabicyclo[4.1.0]hept-5-ene-5-carboxylate Openeye Name: ethyl 4-benzoyl-2-hydroxy-2-phenyl-1,7-diazabicyclo[4.1.0]hept-5-ene-5-carboxylate CAS Name: 4-benzoyl-2-hydroxy-2-phenyl-1,7-diazabicyclo[4.1.0]hept-5-ene-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-benzoyl-2-hydroxy-2-phenyl-1,7-diazabicyclo[4.1.0]hept-5-ene-5-carboxylate Traditional Name: 4-benzoyl-2-hydroxy-2-phenyl-1,7-diazabicyclo[4.1.0]hept-5-ene-5-carboxylic acid ethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2NN2C(CC1C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)C1=C2NN2C(CC1C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C21H20N2O4/c1-2-27-20(25)17-16(18(24)14-9-5-3-6-10-14)13-21(26,23-19(17)22-23)15-11-7-4-8-12-15/h3-12,16,22,26H,2,13H2,1H3