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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)COC2=C(OC3=C(C2=O)C=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)COC2=C(OC3=C(C2=O)C=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

InChI

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