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

Systemtic Name: 2-[3,5-dimethyl-4-[[3-(phenylmethyl)-1H-indol-5-yl]oxy]phenyl]ethanoic acid Openeye Name: 2-[4-[(3-benzyl-1H-indol-5-yl)oxy]-3,5-dimethyl-phenyl]acetic acid CAS Name: 2-[3,5-dimethyl-4-[[3-(phenylmethyl)-1H-indol-5-yl]oxy]phenyl]acetic acid IUPAC Name: 2-[4-[(3-benzyl-1H-indol-5-yl)oxy]-3,5-dimethylphenyl]acetic acid Traditional Name: 2-[4-[(3-benzyl-1H-indol-5-yl)oxy]-3,5-dimethyl-phenyl]acetic acid Formula: C25H23NO3 MolecularWeight: 385.45502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC3=C(C=C2)NC=C3CC4=CC=CC=C4)C)CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC3=C(C=C2)NC=C3CC4=CC=CC=C4)C)CC(=O)O

InChI

InChI=1S/C25H23NO3/c1-16-10-19(13-24(27)28)11-17(2)25(16)29-21-8-9-23-22(14-21)20(15-26-23)12-18-6-4-3-5-7-18/h3-11,14-15,26H,12-13H2,1-2H3,(H,27,28)