2-[3-(4-bromophenyl)-5,9-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl]ethanoic acid

Systemtic Name: 2-[3-(4-bromophenyl)-5,9-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl]ethanoic acid Openeye Name: 2-[3-(4-bromophenyl)-5,9-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl]acetic acid CAS Name: 2-[3-(4-bromophenyl)-5,9-dimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl]acetic acid IUPAC Name: 2-[3-(4-bromophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetic acid Traditional Name: 2-[3-(4-bromophenyl)-7-keto-5,9-dimethyl-furo[3,2-g]chromen-6-yl]acetic acid Formula: C21H15BrO5 MolecularWeight: 427.2448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C4=CC=C(C=C4)Br)CC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C4=CC=C(C=C4)Br)CC(=O)O

InChI

InChI=1S/C21H15BrO5/c1-10-14-7-16-17(12-3-5-13(22)6-4-12)9-26-19(16)11(2)20(14)27-21(25)15(10)8-18(23)24/h3-7,9H,8H2,1-2H3,(H,23,24)