2-[6-bromanyl-4-(4-chlorophenyl)-2-oxidanylidene-chromen-3-yl]pentanoic acid

Systemtic Name: 2-[6-bromanyl-4-(4-chlorophenyl)-2-oxidanylidene-chromen-3-yl]pentanoic acid Openeye Name: 2-[6-bromo-4-(4-chlorophenyl)-2-oxo-chromen-3-yl]pentanoic acid CAS Name: 2-[6-bromo-4-(4-chlorophenyl)-2-oxo-1-benzopyran-3-yl]pentanoic acid IUPAC Name: 2-[6-bromo-4-(4-chlorophenyl)-2-oxochromen-3-yl]pentanoic acid Traditional Name: 2-[6-bromo-4-(4-chlorophenyl)-2-keto-chromen-3-yl]valeric acid Formula: C20H16BrClO4 MolecularWeight: 435.69564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C2=C(C=CC(=C2)Br)OC1=O)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCC(C1=C(C2=C(C=CC(=C2)Br)OC1=O)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C20H16BrClO4/c1-2-3-14(19(23)24)18-17(11-4-7-13(22)8-5-11)15-10-12(21)6-9-16(15)26-20(18)25/h4-10,14H,2-3H2,1H3,(H,23,24)