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

Systemtic Name: 6-tert-butyl-4-[4-(4-ethanoylphenyl)phenyl]chromen-2-one Openeye Name: 4-[4-(4-acetylphenyl)phenyl]-6-tert-butyl-chromen-2-one CAS Name: 4-[4-(4-acetylphenyl)phenyl]-6-tert-butyl-1-benzopyran-2-one IUPAC Name: 4-[4-(4-acetylphenyl)phenyl]-6-tert-butylchromen-2-one Traditional Name: 4-[4-(4-acetylphenyl)phenyl]-6-tert-butyl-coumarin Formula: C27H24O3 MolecularWeight: 396.47766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=O)OC4=C3C=C(C=C4)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=O)OC4=C3C=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H24O3/c1-17(28)18-5-7-19(8-6-18)20-9-11-21(12-10-20)23-16-26(29)30-25-14-13-22(15-24(23)25)27(2,3)4/h5-16H,1-4H3