2-[4-(1-methyl-3-pentyl-2-phenyl-indol-5-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(1-methyl-3-pentyl-2-phenyl-indol-5-yl)phenoxy]ethanoic acid Openeye Name: 2-[4-(1-methyl-3-pentyl-2-phenyl-indol-5-yl)phenoxy]acetic acid CAS Name: 2-[4-(1-methyl-3-pentyl-2-phenyl-5-indolyl)phenoxy]acetic acid IUPAC Name: 2-[4-(1-methyl-3-pentyl-2-phenylindol-5-yl)phenoxy]acetic acid Traditional Name: 2-[4-(3-amyl-1-methyl-2-phenyl-indol-5-yl)phenoxy]acetic acid Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N(C2=C1C=C(C=C2)C3=CC=C(C=C3)OCC(=O)O)C)C4=CC=CC=C4

Isomeric SMILES

CCCCCC1=C(N(C2=C1C=C(C=C2)C3=CC=C(C=C3)OCC(=O)O)C)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO3/c1-3-4-6-11-24-25-18-22(20-12-15-23(16-13-20)32-19-27(30)31)14-17-26(25)29(2)28(24)21-9-7-5-8-10-21/h5,7-10,12-18H,3-4,6,11,19H2,1-2H3,(H,30,31)