3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid IUPAC Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1H-indol-5-yl)phenyl]propionic acid Formula: C27H28N2O3 MolecularWeight: 428.52282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)NC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)NC=C4

InChI

InChI=1S/C27H28N2O3/c1-29(2)23-8-3-19(4-9-23)14-16-32-26-11-5-20(6-12-27(30)31)17-24(26)21-7-10-25-22(18-21)13-15-28-25/h3-5,7-11,13,15,17-18,28H,6,12,14,16H2,1-2H3,(H,30,31)