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

Systemtic Name: methyl 4-[[2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxo-chromen-3-yl]oxymethyl]benzoate CAS Name: 4-[[2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxo-1-benzopyran-3-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxochromen-3-yl]oxymethyl]benzoate Traditional Name: 4-[[2-(4-tert-butylphenyl)-6-chloro-4-keto-7-methyl-chromen-3-yl]oxymethyl]benzoic acid methyl ester Formula: C29H27ClO5 MolecularWeight: 490.97468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC3=CC=C(C=C3)C(=O)OC)C4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC3=CC=C(C=C3)C(=O)OC)C4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C29H27ClO5/c1-17-14-24-22(15-23(17)30)25(31)27(34-16-18-6-8-20(9-7-18)28(32)33-5)26(35-24)19-10-12-21(13-11-19)29(2,3)4/h6-15H,16H2,1-5H3