(4-methylphenyl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: (4-methylphenyl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: p-tolylmethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (4-methylbenzyl) ester Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H17N3O2/c1-14-2-4-16(5-3-14)11-23-18(22)17-8-6-15(7-9-17)10-21-13-19-12-20-21/h2-9,12-13H,10-11H2,1H3