6-tert-butyl-4-[4-(4-phenylphenyl)phenyl]chromen-2-one

Systemtic Name: 6-tert-butyl-4-[4-(4-phenylphenyl)phenyl]chromen-2-one Openeye Name: 6-tert-butyl-4-[4-(4-phenylphenyl)phenyl]chromen-2-one CAS Name: 6-tert-butyl-4-[4-(4-phenylphenyl)phenyl]-1-benzopyran-2-one IUPAC Name: 6-tert-butyl-4-[4-(4-phenylphenyl)phenyl]chromen-2-one Traditional Name: 6-tert-butyl-4-[4-(4-phenylphenyl)phenyl]coumarin Formula: C31H26O2 MolecularWeight: 430.53694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=O)C=C2C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=O)C=C2C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H26O2/c1-31(2,3)26-17-18-29-28(19-26)27(20-30(32)33-29)25-15-13-24(14-16-25)23-11-9-22(10-12-23)21-7-5-4-6-8-21/h4-20H,1-3H3