3-ethyl-2-indol-1-yl-5-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]octanoic acid

Systemtic Name: 3-ethyl-2-indol-1-yl-5-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]octanoic acid Openeye Name: 3-ethyl-2-indol-1-yl-5-[2-(2H-tetrazol-5-yl)phenyl]octanoic acid CAS Name: 3-ethyl-2-(1-indolyl)-5-[2-(2H-tetrazol-5-yl)phenyl]octanoic acid IUPAC Name: 3-ethyl-2-indol-1-yl-5-[2-(2H-tetrazol-5-yl)phenyl]octanoic acid Traditional Name: 3-ethyl-2-indol-1-yl-5-[2-(2H-tetrazol-5-yl)phenyl]caprylic acid Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(CC)C(C(=O)O)N1C=CC2=CC=CC=C21)C3=CC=CC=C3C4=NNN=N4

Isomeric SMILES

CCCC(CC(CC)C(C(=O)O)N1C=CC2=CC=CC=C21)C3=CC=CC=C3C4=NNN=N4

InChI

InChI=1S/C25H29N5O2/c1-3-9-19(20-11-6-7-12-21(20)24-26-28-29-27-24)16-17(4-2)23(25(31)32)30-15-14-18-10-5-8-13-22(18)30/h5-8,10-15,17,19,23H,3-4,9,16H2,1-2H3,(H,31,32)(H,26,27,28,29)