2-indol-1-yl-4-methyl-3-pyridin-3-yl-octanoic acid

Systemtic Name: 2-indol-1-yl-4-methyl-3-pyridin-3-yl-octanoic acid Openeye Name: 2-indol-1-yl-4-methyl-3-(3-pyridyl)octanoic acid CAS Name: 2-(1-indolyl)-4-methyl-3-(3-pyridinyl)octanoic acid IUPAC Name: 2-indol-1-yl-4-methyl-3-pyridin-3-yloctanoic acid Traditional Name: 2-indol-1-yl-4-methyl-3-(3-pyridyl)caprylic acid Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C1=CN=CC=C1)C(C(=O)O)N2C=CC3=CC=CC=C32

Isomeric SMILES

CCCCC(C)C(C1=CN=CC=C1)C(C(=O)O)N2C=CC3=CC=CC=C32

InChI

InChI=1S/C22H26N2O2/c1-3-4-8-16(2)20(18-10-7-13-23-15-18)21(22(25)26)24-14-12-17-9-5-6-11-19(17)24/h5-7,9-16,20-21H,3-4,8H2,1-2H3,(H,25,26)