(2-phenyl-5-propyl-1,2,4-triazol-3-yl) ethanoate

Systemtic Name: (2-phenyl-5-propyl-1,2,4-triazol-3-yl) ethanoate Openeye Name: (2-phenyl-5-propyl-1,2,4-triazol-3-yl) acetate CAS Name: acetic acid (2-phenyl-5-propyl-1,2,4-triazol-3-yl) ester IUPAC Name: (2-phenyl-5-propyl-1,2,4-triazol-3-yl) acetate Traditional Name: acetic acid (2-phenyl-5-propyl-1,2,4-triazol-3-yl) ester Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=N1)OC(=O)C)C2=CC=CC=C2

Isomeric SMILES

CCCC1=NN(C(=N1)OC(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-3-7-12-14-13(18-10(2)17)16(15-12)11-8-5-4-6-9-11/h4-6,8-9H,3,7H2,1-2H3