hexyl 2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate

Systemtic Name: hexyl 2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate Openeye Name: hexyl 2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate CAS Name: 2-(1,2,4-triazol-1-ylmethyl)-2-propenoic acid hexyl ester IUPAC Name: hexyl 2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate Traditional Name: 2-(1,2,4-triazol-1-ylmethyl)acrylic acid hexyl ester Formula: C12H19N3O2 MolecularWeight: 237.29816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=C)CN1C=NC=N1

Isomeric SMILES

CCCCCCOC(=O)C(=C)CN1C=NC=N1

InChI

InChI=1S/C12H19N3O2/c1-3-4-5-6-7-17-12(16)11(2)8-15-10-13-9-14-15/h9-10H,2-8H2,1H3