4-[(E)-3-methyl-4-oxidanyl-but-2-enyl]-1,2-diphenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[(E)-3-methyl-4-oxidanyl-but-2-enyl]-1,2-diphenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(E)-4-hydroxy-3-methyl-but-2-enyl]-1,2-diphenyl-pyrazolidine-3,5-dione CAS Name: 4-[(E)-4-hydroxy-3-methylbut-2-enyl]-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: 4-[(E)-4-hydroxy-3-methylbut-2-enyl]-1,2-diphenylpyrazolidine-3,5-dione Traditional Name: 4-[(E)-4-hydroxy-3-methyl-but-2-enyl]-1,2-diphenyl-pyrazolidine-3,5-quinone Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CO

Isomeric SMILES

C/C(=C\CC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)/CO

InChI

InChI=1S/C20H20N2O3/c1-15(14-23)12-13-18-19(24)21(16-8-4-2-5-9-16)22(20(18)25)17-10-6-3-7-11-17/h2-12,18,23H,13-14H2,1H3/b15-12+