[2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-4-oxidanylidene-chromen-3-yl] 3-chloranylbenzoate

Systemtic Name: [2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-4-oxidanylidene-chromen-3-yl] 3-chloranylbenzoate Openeye Name: [2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxo-chromen-3-yl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxochromen-3-yl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-(4-tert-butylphenyl)-6-chloro-4-keto-7-methyl-chromen-3-yl] ester Formula: C27H22Cl2O4 MolecularWeight: 481.36718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C27H22Cl2O4/c1-15-12-22-20(14-21(15)29)23(30)25(33-26(31)17-6-5-7-19(28)13-17)24(32-22)16-8-10-18(11-9-16)27(2,3)4/h5-14H,1-4H3