1-[(3-methyl-6-nonyl-3,6-dihydro-2H-pyran-5-yl)methyl]-1,2,4-triazole

Systemtic Name: 1-[(3-methyl-6-nonyl-3,6-dihydro-2H-pyran-5-yl)methyl]-1,2,4-triazole Openeye Name: 1-[(3-methyl-6-nonyl-3,6-dihydro-2H-pyran-5-yl)methyl]-1,2,4-triazole CAS Name: 1-[(3-methyl-6-nonyl-3,6-dihydro-2H-pyran-5-yl)methyl]-1,2,4-triazole IUPAC Name: 1-[(3-methyl-6-nonyl-3,6-dihydro-2H-pyran-5-yl)methyl]-1,2,4-triazole Traditional Name: 1-[(3-methyl-6-nonyl-3,6-dihydro-2H-pyran-5-yl)methyl]-1,2,4-triazole Formula: C18H31N3O MolecularWeight: 305.45824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1C(=CC(CO1)C)CN2C=NC=N2

Isomeric SMILES

CCCCCCCCCC1C(=CC(CO1)C)CN2C=NC=N2

InChI

InChI=1S/C18H31N3O/c1-3-4-5-6-7-8-9-10-18-17(11-16(2)13-22-18)12-21-15-19-14-20-21/h11,14-16,18H,3-10,12-13H2,1-2H3