5,5-dibutyl-2-(2-chlorophenyl)-1,2,4-triazolidin-3-one

Systemtic Name: 5,5-dibutyl-2-(2-chlorophenyl)-1,2,4-triazolidin-3-one Openeye Name: 5,5-dibutyl-2-(2-chlorophenyl)-1,2,4-triazolidin-3-one CAS Name: 5,5-dibutyl-2-(2-chlorophenyl)-1,2,4-triazolidin-3-one IUPAC Name: 5,5-dibutyl-2-(2-chlorophenyl)-1,2,4-triazolidin-3-one Traditional Name: 5,5-dibutyl-2-(2-chlorophenyl)-1,2,4-triazolidin-3-one Formula: C16H24ClN3O MolecularWeight: 309.83426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(NC(=O)N(N1)C2=CC=CC=C2Cl)CCCC

Isomeric SMILES

CCCCC1(NC(=O)N(N1)C2=CC=CC=C2Cl)CCCC

InChI

InChI=1S/C16H24ClN3O/c1-3-5-11-16(12-6-4-2)18-15(21)20(19-16)14-10-8-7-9-13(14)17/h7-10,19H,3-6,11-12H2,1-2H3,(H,18,21)