(E)-2-methyl-6-(1-pyridin-3-ylindol-3-yl)hex-5-enoic acid

Systemtic Name: (E)-2-methyl-6-(1-pyridin-3-ylindol-3-yl)hex-5-enoic acid Openeye Name: (E)-2-methyl-6-[1-(3-pyridyl)indol-3-yl]hex-5-enoic acid CAS Name: (E)-2-methyl-6-[1-(3-pyridinyl)-3-indolyl]-5-hexenoic acid IUPAC Name: (E)-2-methyl-6-(1-pyridin-3-ylindol-3-yl)hex-5-enoic acid Traditional Name: (E)-2-methyl-6-[1-(3-pyridyl)indol-3-yl]hex-5-enoic acid Formula: C20H20N2O2 MolecularWeight: 320.385

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=CC1=CN(C2=CC=CC=C21)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CC(CC/C=C/C1=CN(C2=CC=CC=C21)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C20H20N2O2/c1-15(20(23)24)7-2-3-8-16-14-22(17-9-6-12-21-13-17)19-11-5-4-10-18(16)19/h3-6,8-15H,2,7H2,1H3,(H,23,24)/b8-3+