[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (3-o-phenetyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C21H19N5O4/c1-2-28-18-6-4-3-5-17(18)20-24-19(30-25-20)12-29-21(27)16-9-7-15(8-10-16)11-26-14-22-13-23-26/h3-10,13-14H,2,11-12H2,1H3