3-[[6-chloranyl-2-(4-methoxyphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoic acid

Systemtic Name: 3-[[6-chloranyl-2-(4-methoxyphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoic acid Openeye Name: 3-[[6-chloro-2-(4-methoxyphenyl)-4-oxo-chromen-3-yl]oxymethyl]benzoic acid CAS Name: 3-[[6-chloro-2-(4-methoxyphenyl)-4-oxo-1-benzopyran-3-yl]oxymethyl]benzoic acid IUPAC Name: 3-[[6-chloro-2-(4-methoxyphenyl)-4-oxochromen-3-yl]oxymethyl]benzoic acid Traditional Name: 3-[[6-chloro-4-keto-2-(4-methoxyphenyl)chromen-3-yl]oxymethyl]benzoic acid Formula: C24H17ClO6 MolecularWeight: 436.84118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C24H17ClO6/c1-29-18-8-5-15(6-9-18)22-23(21(26)19-12-17(25)7-10-20(19)31-22)30-13-14-3-2-4-16(11-14)24(27)28/h2-12H,13H2,1H3,(H,27,28)