2-[2-(3,4-diethoxyphenyl)-5-propan-2-yl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3,4-diethoxyphenyl)-5-propan-2-yl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3,4-diethoxyphenyl)-5-isopropyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3,4-diethoxyphenyl)-5-propan-2-yl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3,4-diethoxyphenyl)-5-propan-2-yl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3,4-diethoxyphenyl)-5-isopropyl-1H-indol-3-yl]acetic acid Formula: C23H27NO4 MolecularWeight: 381.46478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)C)CC(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)C)CC(=O)O)OCC

InChI

InChI=1S/C23H27NO4/c1-5-27-20-10-8-16(12-21(20)28-6-2)23-18(13-22(25)26)17-11-15(14(3)4)7-9-19(17)24-23/h7-12,14,24H,5-6,13H2,1-4H3,(H,25,26)