7-oxidanylidene-1,2,3,4-tetraphenyl-6-(phenylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate

Systemtic Name: 7-oxidanylidene-1,2,3,4-tetraphenyl-6-(phenylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate Openeye Name: 7-oxo-1,2,3,4-tetraphenyl-6-(phenylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate CAS Name: 6-[anilino(oxo)methyl]-7-oxo-1,2,3,4-tetraphenyl-5-bicyclo[2.2.1]hept-2-enecarboxylate IUPAC Name: 7-oxo-1,2,3,4-tetraphenyl-6-(phenylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate Traditional Name: 7-keto-1,2,3,4-tetraphenyl-6-(phenylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate Formula: C39H28NO4- MolecularWeight: 574.64392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3(C(C(C2(C3=O)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5)C(=O)[O-])C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3(C(C(C2(C3=O)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5)C(=O)[O-])C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C39H29NO4/c41-35(40-30-24-14-5-15-25-30)33-34(36(42)43)39(29-22-12-4-13-23-29)32(27-18-8-2-9-19-27)31(26-16-6-1-7-17-26)38(33,37(39)44)28-20-10-3-11-21-28/h1-25,33-34H,(H,40,41)(H,42,43)/p-1