6-(3-methyl-5-phenylmethoxy-2-pyridin-3-yl-indol-1-yl)hexanoic acid

Systemtic Name: 6-(3-methyl-5-phenylmethoxy-2-pyridin-3-yl-indol-1-yl)hexanoic acid Openeye Name: 6-[5-benzyloxy-3-methyl-2-(3-pyridyl)indol-1-yl]hexanoic acid CAS Name: 6-[3-methyl-5-phenylmethoxy-2-(3-pyridinyl)-1-indolyl]hexanoic acid IUPAC Name: 6-(3-methyl-5-phenylmethoxy-2-pyridin-3-ylindol-1-yl)hexanoic acid Traditional Name: 6-[5-benzoxy-3-methyl-2-(3-pyridyl)indol-1-yl]hexanoic acid Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CCCCCC(=O)O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CCCCCC(=O)O)C4=CN=CC=C4

InChI

InChI=1S/C27H28N2O3/c1-20-24-17-23(32-19-21-9-4-2-5-10-21)13-14-25(24)29(16-7-3-6-12-26(30)31)27(20)22-11-8-15-28-18-22/h2,4-5,8-11,13-15,17-18H,3,6-7,12,16,19H2,1H3,(H,30,31)