3-(1-cyclopentylbenzotriazol-5-yl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(1-cyclopentylbenzotriazol-5-yl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole Openeye Name: 3-(1-cyclopentylbenzotriazol-5-yl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole CAS Name: 3-(1-cyclopentyl-5-benzotriazolyl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(1-cyclopentylbenzotriazol-5-yl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole Traditional Name: 3-(1-cyclopentylbenzotriazol-5-yl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=NC(=NO2)C3=CC4=C(C=C3)N(N=N4)C5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=NC(=NO2)C3=CC4=C(C=C3)N(N=N4)C5CCCC5

InChI

InChI=1S/C21H21N5O3/c1-27-16-7-9-17(10-8-16)28-13-20-22-21(24-29-20)14-6-11-19-18(12-14)23-25-26(19)15-4-2-3-5-15/h6-12,15H,2-5,13H2,1H3