2-[2-[2-[4-(phenylcarbonyl)-3-propyl-phenoxy]ethyl]-1H-indol-5-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[4-(phenylcarbonyl)-3-propyl-phenoxy]ethyl]-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[2-[2-(4-benzoyl-3-propyl-phenoxy)ethyl]-1H-indol-5-yl]acetic acid CAS Name: 2-[2-[2-(4-benzoyl-3-propylphenoxy)ethyl]-1H-indol-5-yl]acetic acid IUPAC Name: 2-[2-[2-(4-benzoyl-3-propylphenoxy)ethyl]-1H-indol-5-yl]acetic acid Traditional Name: 2-[2-[2-(4-benzoyl-3-propyl-phenoxy)ethyl]-1H-indol-5-yl]acetic acid Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OCCC2=CC3=C(N2)C=CC(=C3)CC(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCC1=C(C=CC(=C1)OCCC2=CC3=C(N2)C=CC(=C3)CC(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H27NO4/c1-2-6-21-18-24(10-11-25(21)28(32)20-7-4-3-5-8-20)33-14-13-23-17-22-15-19(16-27(30)31)9-12-26(22)29-23/h3-5,7-12,15,17-18,29H,2,6,13-14,16H2,1H3,(H,30,31)