[3-(4-chlorophenyl)-4-oxidanylidene-chromen-7-yl] 4-tert-butylbenzoate

Systemtic Name: [3-(4-chlorophenyl)-4-oxidanylidene-chromen-7-yl] 4-tert-butylbenzoate Openeye Name: [3-(4-chlorophenyl)-4-oxo-chromen-7-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [3-(4-chlorophenyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenyl)-4-oxochromen-7-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [3-(4-chlorophenyl)-4-keto-chromen-7-yl] ester Formula: C26H21ClO4 MolecularWeight: 432.89554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H21ClO4/c1-26(2,3)18-8-4-17(5-9-18)25(29)31-20-12-13-21-23(14-20)30-15-22(24(21)28)16-6-10-19(27)11-7-16/h4-15H,1-3H3