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

Systemtic Name: methyl 4-[[2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[2-(4-tert-butylphenyl)-4-oxo-chromen-3-yl]oxymethyl]benzoate CAS Name: 4-[[2-(4-tert-butylphenyl)-4-oxo-1-benzopyran-3-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-tert-butylphenyl)-4-oxochromen-3-yl]oxymethyl]benzoate Traditional Name: 4-[[2-(4-tert-butylphenyl)-4-keto-chromen-3-yl]oxymethyl]benzoic acid methyl ester Formula: C28H26O5 MolecularWeight: 442.50304

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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)OCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H26O5/c1-28(2,3)21-15-13-19(14-16-21)25-26(24(29)22-7-5-6-8-23(22)33-25)32-17-18-9-11-20(12-10-18)27(30)31-4/h5-16H,17H2,1-4H3