2-[3,5-dimethyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]ethanoic acid

Systemtic Name: 2-[3,5-dimethyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]ethanoic acid Openeye Name: 2-[4-[(3-isobutyl-1H-indol-5-yl)oxy]-3,5-dimethyl-phenyl]acetic acid CAS Name: 2-[3,5-dimethyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]acetic acid IUPAC Name: 2-[3,5-dimethyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]acetic acid Traditional Name: 2-[4-[(3-isobutyl-1H-indol-5-yl)oxy]-3,5-dimethyl-phenyl]acetic acid Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC3=C(C=C2)NC=C3CC(C)C)C)CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC3=C(C=C2)NC=C3CC(C)C)C)CC(=O)O

InChI

InChI=1S/C22H25NO3/c1-13(2)7-17-12-23-20-6-5-18(11-19(17)20)26-22-14(3)8-16(9-15(22)4)10-21(24)25/h5-6,8-9,11-13,23H,7,10H2,1-4H3,(H,24,25)