[3-(4-chlorophenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] 4-tert-butylbenzoate

Systemtic Name: [3-(4-chlorophenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] 4-tert-butylbenzoate Openeye Name: [3-(4-chlorophenyl)-2-methyl-4-oxo-chromen-7-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [3-(4-chlorophenyl)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenyl)-2-methyl-4-oxochromen-7-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [3-(4-chlorophenyl)-4-keto-2-methyl-chromen-7-yl] ester Formula: C27H23ClO4 MolecularWeight: 446.92212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)Cl

InChI

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