2-(3-pentoxyphenyl)-5H-[1,2,4]triazolo[5,1-a]isoindole

Systemtic Name: 2-(3-pentoxyphenyl)-5H-[1,2,4]triazolo[5,1-a]isoindole Openeye Name: 2-(3-pentoxyphenyl)-5H-[1,2,4]triazolo[5,1-a]isoindole CAS Name: 2-(3-pentoxyphenyl)-5H-[1,2,4]triazolo[5,1-a]isoindole IUPAC Name: 2-(3-pentoxyphenyl)-5H-[1,2,4]triazolo[5,1-a]isoindole Traditional Name: 2-(3-amoxyphenyl)-5H-[1,2,4]triazol[5,1-a]isoindole Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C2=NN3CC4=CC=CC=C4C3=N2

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C2=NN3CC4=CC=CC=C4C3=N2

InChI

InChI=1S/C20H21N3O/c1-2-3-6-12-24-17-10-7-9-15(13-17)19-21-20-18-11-5-4-8-16(18)14-23(20)22-19/h4-5,7-11,13H,2-3,6,12,14H2,1H3