1-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]tetradecan-1-one

Systemtic Name: 1-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]tetradecan-1-one Openeye Name: 1-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]tetradecan-1-one CAS Name: 1-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]-1-tetradecanone IUPAC Name: 1-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]tetradecan-1-one Traditional Name: 1-[5-(2-chlorophenyl)-3-propoxy-1,2,4-triazol-1-yl]tetradecan-1-one Formula: C25H38ClN3O2 MolecularWeight: 448.04112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)N1C(=NC(=N1)OCCC)C2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N1C(=NC(=N1)OCCC)C2=CC=CC=C2Cl

InChI

InChI=1S/C25H38ClN3O2/c1-3-5-6-7-8-9-10-11-12-13-14-19-23(30)29-24(21-17-15-16-18-22(21)26)27-25(28-29)31-20-4-2/h15-18H,3-14,19-20H2,1-2H3