2-[(E)-but-2-enoyl]-5,5-dimethyl-1-(phenylmethyl)pyrazolidin-3-one

Systemtic Name: 2-[(E)-but-2-enoyl]-5,5-dimethyl-1-(phenylmethyl)pyrazolidin-3-one Openeye Name: 1-benzyl-2-[(E)-but-2-enoyl]-5,5-dimethyl-pyrazolidin-3-one CAS Name: 5,5-dimethyl-2-[(E)-1-oxobut-2-enyl]-1-(phenylmethyl)-3-pyrazolidinone IUPAC Name: 1-benzyl-2-[(E)-but-2-enoyl]-5,5-dimethylpyrazolidin-3-one Traditional Name: 1-benzyl-2-[(E)-but-2-enoyl]-5,5-dimethyl-pyrazolidin-3-one Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1C(=O)CC(N1CC2=CC=CC=C2)(C)C

Isomeric SMILES

C/C=C/C(=O)N1C(=O)CC(N1CC2=CC=CC=C2)(C)C

InChI

InChI=1S/C16H20N2O2/c1-4-8-14(19)18-15(20)11-16(2,3)17(18)12-13-9-6-5-7-10-13/h4-10H,11-12H2,1-3H3/b8-4+