2-[3-bromanyl-4-[[3-(cyclopropylmethyl)-1H-indol-5-yl]oxy]-5-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[3-bromanyl-4-[[3-(cyclopropylmethyl)-1H-indol-5-yl]oxy]-5-methyl-phenoxy]ethanoic acid Openeye Name: 2-[3-bromo-4-[[3-(cyclopropylmethyl)-1H-indol-5-yl]oxy]-5-methyl-phenoxy]acetic acid CAS Name: 2-[3-bromo-4-[[3-(cyclopropylmethyl)-1H-indol-5-yl]oxy]-5-methylphenoxy]acetic acid IUPAC Name: 2-[3-bromo-4-[[3-(cyclopropylmethyl)-1H-indol-5-yl]oxy]-5-methylphenoxy]acetic acid Traditional Name: 2-[3-bromo-4-[[3-(cyclopropylmethyl)-1H-indol-5-yl]oxy]-5-methyl-phenoxy]acetic acid Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC3=C(C=C2)NC=C3CC4CC4)Br)OCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC3=C(C=C2)NC=C3CC4CC4)Br)OCC(=O)O

InChI

InChI=1S/C21H20BrNO4/c1-12-6-16(26-11-20(24)25)9-18(22)21(12)27-15-4-5-19-17(8-15)14(10-23-19)7-13-2-3-13/h4-6,8-10,13,23H,2-3,7,11H2,1H3,(H,24,25)