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

Systemtic Name: methyl 2-[7-[(4-tert-butylphenyl)methoxy]-6-chloranyl-4-methyl-2-oxidanylidene-chromen-3-yl]ethanoate Openeye Name: methyl 2-[7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-methyl-2-oxo-chromen-3-yl]acetate CAS Name: 2-[7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-methyl-2-oxo-1-benzopyran-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-methyl-2-oxochromen-3-yl]acetate Traditional Name: 2-[7-(4-tert-butylbenzyl)oxy-6-chloro-2-keto-4-methyl-chromen-3-yl]acetic acid methyl ester Formula: C24H25ClO5 MolecularWeight: 428.9053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)C(C)(C)C)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)C(C)(C)C)CC(=O)OC

InChI

InChI=1S/C24H25ClO5/c1-14-17-10-19(25)21(12-20(17)30-23(27)18(14)11-22(26)28-5)29-13-15-6-8-16(9-7-15)24(2,3)4/h6-10,12H,11,13H2,1-5H3