propyl 2-(hydroxymethyl)-3-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: propyl 2-(hydroxymethyl)-3-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: propyl 2-(hydroxymethyl)-3-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 2-(hydroxymethyl)-3-(1,2,4-triazol-1-ylmethyl)benzoic acid propyl ester IUPAC Name: propyl 2-(hydroxymethyl)-3-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 2-methylol-3-(1,2,4-triazol-1-ylmethyl)benzoic acid propyl ester Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C(=CC=C1)CN2C=NC=N2)CO

Isomeric SMILES

CCCOC(=O)C1=C(C(=CC=C1)CN2C=NC=N2)CO

InChI

InChI=1S/C14H17N3O3/c1-2-6-20-14(19)12-5-3-4-11(13(12)8-18)7-17-10-15-9-16-17/h3-5,9-10,18H,2,6-8H2,1H3