methyl 3,7-dimethyl-4-(phenylcarbonyl)-4-azabicyclo[4.2.0]octa-1,6-diene-3-carboxylate

Systemtic Name: methyl 3,7-dimethyl-4-(phenylcarbonyl)-4-azabicyclo[4.2.0]octa-1,6-diene-3-carboxylate Openeye Name: methyl 4-benzoyl-3,7-dimethyl-4-azabicyclo[4.2.0]octa-1,6-diene-3-carboxylate CAS Name: 4-benzoyl-3,7-dimethyl-4-azabicyclo[4.2.0]octa-1,6-diene-3-carboxylic acid methyl ester IUPAC Name: methyl 4-benzoyl-3,7-dimethyl-4-azabicyclo[4.2.0]octa-1,6-diene-3-carboxylate Traditional Name: 4-benzoyl-3,7-dimethyl-4-azabicyclo[4.2.0]octa-1,6-diene-3-carboxylic acid methyl ester Formula: C18H19NO3 MolecularWeight: 297.34836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CN(C(C=C2C1)(C)C(=O)OC)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C2CN(C(C=C2C1)(C)C(=O)OC)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO3/c1-12-9-14-10-18(2,17(21)22-3)19(11-15(12)14)16(20)13-7-5-4-6-8-13/h4-8,10H,9,11H2,1-3H3