[2-(4-tert-butylphenyl)-6-chloranyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate

Systemtic Name: [2-(4-tert-butylphenyl)-6-chloranyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate Openeye Name: [2-(4-tert-butylphenyl)-6-chloro-4-oxo-chromen-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(4-tert-butylphenyl)-6-chloro-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-6-chloro-4-oxochromen-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-(4-tert-butylphenyl)-6-chloro-4-keto-chromen-3-yl] ester Formula: C27H23ClO4 MolecularWeight: 446.92212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(OC3=C(C2=O)C=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(OC3=C(C2=O)C=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H23ClO4/c1-16-5-7-18(8-6-16)26(30)32-25-23(29)21-15-20(28)13-14-22(21)31-24(25)17-9-11-19(12-10-17)27(2,3)4/h5-15H,1-4H3