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

Systemtic Name: 2-[3-chloranyl-5-methyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]ethanoic acid Openeye Name: 2-[3-chloro-4-[(3-isobutyl-1H-indol-5-yl)oxy]-5-methyl-phenyl]acetic acid CAS Name: 2-[3-chloro-5-methyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]acetic acid IUPAC Name: 2-[3-chloro-5-methyl-4-[[3-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]acetic acid Traditional Name: 2-[3-chloro-4-[(3-isobutyl-1H-indol-5-yl)oxy]-5-methyl-phenyl]acetic acid Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(=O)O)Cl)OC2=CC3=C(C=C2)NC=C3CC(C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(=O)O)Cl)OC2=CC3=C(C=C2)NC=C3CC(C)C

InChI

InChI=1S/C21H22ClNO3/c1-12(2)6-15-11-23-19-5-4-16(10-17(15)19)26-21-13(3)7-14(8-18(21)22)9-20(24)25/h4-5,7-8,10-12,23H,6,9H2,1-3H3,(H,24,25)