[2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]methyl decanoate

Systemtic Name: [2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]methyl decanoate Openeye Name: [2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]methyl decanoate CAS Name: decanoic acid [2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]methyl ester IUPAC Name: [2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]methyl decanoate Traditional Name: capric acid [2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]benzyl] ester Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OCC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCCCCC(=O)OCC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C26H33N3O3/c1-3-4-5-6-7-8-9-17-24(30)32-19-21-13-10-11-16-23(21)26-27-25(28-29-26)20-14-12-15-22(18-20)31-2/h10-16,18H,3-9,17,19H2,1-2H3,(H,27,28,29)