2-(diphenylmethylidene)-7-(phenethylcarbamoyl)bicyclo[2.2.1]hept-4-ene-6-carboxylic acid

Systemtic Name: 2-(diphenylmethylidene)-7-(phenethylcarbamoyl)bicyclo[2.2.1]hept-4-ene-6-carboxylic acid Openeye Name: 2-benzhydrylidene-7-(phenethylcarbamoyl)bicyclo[2.2.1]hept-4-ene-6-carboxylic acid CAS Name: 2-(diphenylmethylene)-7-[oxo-(phenethylamino)methyl]-6-bicyclo[2.2.1]hept-4-enecarboxylic acid IUPAC Name: 2-benzhydrylidene-7-(phenethylcarbamoyl)bicyclo[2.2.1]hept-4-ene-6-carboxylic acid Traditional Name: 2-benzhydrylidene-7-(phenethylcarbamoyl)bicyclo[2.2.1]hept-4-ene-6-carboxylic acid Formula: C30H27NO3 MolecularWeight: 449.54028

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(C(C2C(=O)NCCC3=CC=CC=C3)C1=C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C2=CC(C(C2C(=O)NCCC3=CC=CC=C3)C1=C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C30H27NO3/c32-29(31-17-16-20-10-4-1-5-11-20)27-23-18-24(28(27)25(19-23)30(33)34)26(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,19,25,27-28H,16-18H2,(H,31,32)(H,33,34)