3,3-dimethyl-1-(2-pent-4-ynoylpyrazolidin-1-yl)pentane-1,2-dione

Systemtic Name: 3,3-dimethyl-1-(2-pent-4-ynoylpyrazolidin-1-yl)pentane-1,2-dione Openeye Name: 3,3-dimethyl-1-(2-pent-4-ynoylpyrazolidin-1-yl)pentane-1,2-dione CAS Name: 3,3-dimethyl-1-[2-(1-oxopent-4-ynyl)-1-pyrazolidinyl]pentane-1,2-dione IUPAC Name: 3,3-dimethyl-1-(2-pent-4-ynoylpyrazolidin-1-yl)pentane-1,2-dione Traditional Name: 3,3-dimethyl-1-(2-pent-4-ynoylpyrazolidin-1-yl)pentane-1,2-dione Formula: C15H22N2O3 MolecularWeight: 278.34678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCN1C(=O)CCC#C

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCCN1C(=O)CCC#C

InChI

InChI=1S/C15H22N2O3/c1-5-7-9-12(18)16-10-8-11-17(16)14(20)13(19)15(3,4)6-2/h1H,6-11H2,2-4H3