2-[3,5-bis(bromanyl)-4-[(3-cyclohexyl-1H-indol-5-yl)oxy]phenyl]ethanoic acid

Systemtic Name: 2-[3,5-bis(bromanyl)-4-[(3-cyclohexyl-1H-indol-5-yl)oxy]phenyl]ethanoic acid Openeye Name: 2-[3,5-dibromo-4-[(3-cyclohexyl-1H-indol-5-yl)oxy]phenyl]acetic acid CAS Name: 2-[3,5-dibromo-4-[(3-cyclohexyl-1H-indol-5-yl)oxy]phenyl]acetic acid IUPAC Name: 2-[3,5-dibromo-4-[(3-cyclohexyl-1H-indol-5-yl)oxy]phenyl]acetic acid Traditional Name: 2-[3,5-dibromo-4-[(3-cyclohexyl-1H-indol-5-yl)oxy]phenyl]acetic acid Formula: C22H21Br2NO3 MolecularWeight: 507.21504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CNC3=C2C=C(C=C3)OC4=C(C=C(C=C4Br)CC(=O)O)Br

Isomeric SMILES

C1CCC(CC1)C2=CNC3=C2C=C(C=C3)OC4=C(C=C(C=C4Br)CC(=O)O)Br

InChI

InChI=1S/C22H21Br2NO3/c23-18-8-13(10-21(26)27)9-19(24)22(18)28-15-6-7-20-16(11-15)17(12-25-20)14-4-2-1-3-5-14/h6-9,11-12,14,25H,1-5,10H2,(H,26,27)