(E)-8-(3-methyl-2-pyridin-3-yl-indol-1-yl)oct-2-enoic acid

Systemtic Name: (E)-8-(3-methyl-2-pyridin-3-yl-indol-1-yl)oct-2-enoic acid Openeye Name: (E)-8-[3-methyl-2-(3-pyridyl)indol-1-yl]oct-2-enoic acid CAS Name: (E)-8-[3-methyl-2-(3-pyridinyl)-1-indolyl]-2-octenoic acid IUPAC Name: (E)-8-(3-methyl-2-pyridin-3-ylindol-1-yl)oct-2-enoic acid Traditional Name: (E)-8-[3-methyl-2-(3-pyridyl)indol-1-yl]oct-2-enoic acid Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)CCCCCC=CC(=O)O)C3=CN=CC=C3

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)CCCCC/C=C/C(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C22H24N2O2/c1-17-19-11-6-7-12-20(19)24(22(17)18-10-9-14-23-16-18)15-8-4-2-3-5-13-21(25)26/h5-7,9-14,16H,2-4,8,15H2,1H3,(H,25,26)/b13-5+