(4-oxidanylidene-3-phenyl-chromen-7-yl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: (4-oxidanylidene-3-phenyl-chromen-7-yl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: (4-oxo-3-phenyl-chromen-7-yl) 4-(4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)butanoic acid (4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenylchromen-7-yl) 4-(4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)butyric acid (4-keto-3-phenyl-chromen-7-yl) ester Formula: C27H23ClO5 MolecularWeight: 462.92152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4

InChI

InChI=1S/C27H23ClO5/c1-17-13-21(14-18(2)26(17)28)31-12-6-9-25(29)33-20-10-11-22-24(15-20)32-16-23(27(22)30)19-7-4-3-5-8-19/h3-5,7-8,10-11,13-16H,6,9,12H2,1-2H3