(E)-7-(1-pyridin-3-ylindol-3-yl)hept-6-enoic acid

Systemtic Name: (E)-7-(1-pyridin-3-ylindol-3-yl)hept-6-enoic acid Openeye Name: (E)-7-[1-(3-pyridyl)indol-3-yl]hept-6-enoic acid CAS Name: (E)-7-[1-(3-pyridinyl)-3-indolyl]-6-heptenoic acid IUPAC Name: (E)-7-(1-pyridin-3-ylindol-3-yl)hept-6-enoic acid Traditional Name: (E)-7-[1-(3-pyridyl)indol-3-yl]hept-6-enoic acid Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)/C=C/CCCCC(=O)O

InChI

InChI=1S/C20H20N2O2/c23-20(24)12-4-2-1-3-8-16-15-22(17-9-7-13-21-14-17)19-11-6-5-10-18(16)19/h3,5-11,13-15H,1-2,4,12H2,(H,23,24)/b8-3+