2-[3,5-bis(bromanyl)-4-[4-methoxy-2-[(3-methylphenyl)-thiophen-2-yl-methyl]-5-propan-2-yl-phenoxy]phenyl]ethanoic acid

Systemtic Name: 2-[3,5-bis(bromanyl)-4-[4-methoxy-2-[(3-methylphenyl)-thiophen-2-yl-methyl]-5-propan-2-yl-phenoxy]phenyl]ethanoic acid Openeye Name: 2-[3,5-dibromo-4-[5-isopropyl-4-methoxy-2-[m-tolyl(2-thienyl)methyl]phenoxy]phenyl]acetic acid CAS Name: 2-[3,5-dibromo-4-[4-methoxy-2-[(3-methylphenyl)-thiophen-2-ylmethyl]-5-propan-2-ylphenoxy]phenyl]acetic acid IUPAC Name: 2-[3,5-dibromo-4-[4-methoxy-2-[(3-methylphenyl)-thiophen-2-ylmethyl]-5-propan-2-ylphenoxy]phenyl]acetic acid Traditional Name: 2-[3,5-dibromo-4-[5-isopropyl-4-methoxy-2-[m-tolyl(2-thienyl)methyl]phenoxy]phenyl]acetic acid Formula: C30H28Br2O4S MolecularWeight: 644.41392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CS2)C3=CC(=C(C=C3OC4=C(C=C(C=C4Br)CC(=O)O)Br)C(C)C)OC

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CS2)C3=CC(=C(C=C3OC4=C(C=C(C=C4Br)CC(=O)O)Br)C(C)C)OC

InChI

InChI=1S/C30H28Br2O4S/c1-17(2)21-15-26(36-30-23(31)12-19(13-24(30)32)14-28(33)34)22(16-25(21)35-4)29(27-9-6-10-37-27)20-8-5-7-18(3)11-20/h5-13,15-17,29H,14H2,1-4H3,(H,33,34)