1-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline

Systemtic Name: 1-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline Openeye Name: 1-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline CAS Name: 1-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline IUPAC Name: 1-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline Traditional Name: 1-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline Formula: C18H14N4O MolecularWeight: 302.32996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=N2)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=N2)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C18H14N4O/c1-23-14-7-4-6-13(11-14)17-20-18(22-21-17)16-15-8-3-2-5-12(15)9-10-19-16/h2-11H,1H3,(H,20,21,22)