[4-(4-cyanophenyl)phenyl] 9H-xanthene-9-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 9H-xanthene-9-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C27H17NO3 MolecularWeight: 403.42878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H17NO3/c28-17-18-9-11-19(12-10-18)20-13-15-21(16-14-20)30-27(29)26-22-5-1-3-7-24(22)31-25-8-4-2-6-23(25)26/h1-16,26H