3-oxidanyl-2,4,6-triphenyl-benzenecarbonitrile

Systemtic Name: 3-oxidanyl-2,4,6-triphenyl-benzenecarbonitrile Openeye Name: 3-hydroxy-2,4,6-triphenyl-benzonitrile CAS Name: 3-hydroxy-2,4,6-triphenylbenzonitrile IUPAC Name: 3-hydroxy-2,4,6-triphenylbenzonitrile Traditional Name: 3-hydroxy-2,4,6-triphenyl-benzonitrile Formula: C50H34N2O2 MolecularWeight: 694.81716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)C3=CC=CC=C3)O)C4=CC=CC=C4.C1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)C3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)C3=CC=CC=C3)O)C4=CC=CC=C4.C1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)C3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/2C25H17NO/c2*26-17-23-21(18-10-4-1-5-11-18)16-22(19-12-6-2-7-13-19)25(27)24(23)20-14-8-3-9-15-20/h2*1-16,27H