2-[bis[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]benzoic acid

Systemtic Name: 2-[bis[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]benzoic acid Openeye Name: 2-[bis(3,5-dibromo-4-methoxy-phenyl)methyl]benzoic acid CAS Name: 2-[bis(3,5-dibromo-4-methoxyphenyl)methyl]benzoic acid IUPAC Name: 2-[bis(3,5-dibromo-4-methoxyphenyl)methyl]benzoic acid Traditional Name: 2-[bis(3,5-dibromo-4-methoxy-phenyl)methyl]benzoic acid Formula: C22H16Br4O4 MolecularWeight: 663.97604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C(C2=CC=CC=C2C(=O)O)C3=CC(=C(C(=C3)Br)OC)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1Br)C(C2=CC=CC=C2C(=O)O)C3=CC(=C(C(=C3)Br)OC)Br)Br

InChI

InChI=1S/C22H16Br4O4/c1-29-20-15(23)7-11(8-16(20)24)19(13-5-3-4-6-14(13)22(27)28)12-9-17(25)21(30-2)18(26)10-12/h3-10,19H,1-2H3,(H,27,28)