[2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl] benzoate

Systemtic Name: [2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl] benzoate Openeye Name: [2-(4-tert-butylphenyl)-4-oxo-chromen-3-yl] benzoate CAS Name: benzoic acid [2-(4-tert-butylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-4-oxochromen-3-yl] benzoate Traditional Name: benzoic acid [2-(4-tert-butylphenyl)-4-keto-chromen-3-yl] ester Formula: C26H22O4 MolecularWeight: 398.45048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H22O4/c1-26(2,3)19-15-13-17(14-16-19)23-24(30-25(28)18-9-5-4-6-10-18)22(27)20-11-7-8-12-21(20)29-23/h4-16H,1-3H3