1-(1,2,4-triazol-1-yl)octadecan-1-one

Systemtic Name: 1-(1,2,4-triazol-1-yl)octadecan-1-one Openeye Name: 1-(1,2,4-triazol-1-yl)octadecan-1-one CAS Name: 1-(1,2,4-triazol-1-yl)-1-octadecanone IUPAC Name: 1-(1,2,4-triazol-1-yl)octadecan-1-one Traditional Name: 1-(1,2,4-triazol-1-yl)octadecan-1-one Formula: C20H37N3O MolecularWeight: 335.52728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N1C=NC=N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N1C=NC=N1

InChI

InChI=1S/C20H37N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)23-19-21-18-22-23/h18-19H,2-17H2,1H3