3-(1-pyridin-3-ylindol-3-yl)propanoic acid

Systemtic Name: 3-(1-pyridin-3-ylindol-3-yl)propanoic acid Openeye Name: 3-[1-(3-pyridyl)indol-3-yl]propanoic acid CAS Name: 3-[1-(3-pyridinyl)-3-indolyl]propanoic acid IUPAC Name: 3-(1-pyridin-3-ylindol-3-yl)propanoic acid Traditional Name: 3-[1-(3-pyridyl)indol-3-yl]propionic acid Formula: C16H14N2O2 MolecularWeight: 266.29456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)CCC(=O)O

InChI

InChI=1S/C16H14N2O2/c19-16(20)8-7-12-11-18(13-4-3-9-17-10-13)15-6-2-1-5-14(12)15/h1-6,9-11H,7-8H2,(H,19,20)