4-(4,4-dimethyl-3-oxidanyl-pentyl)-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-(4,4-dimethyl-3-oxidanyl-pentyl)-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-(3-hydroxy-4,4-dimethyl-pentyl)-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-dione CAS Name: 4-(3-hydroxy-4,4-dimethylpentyl)-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione IUPAC Name: 4-(3-hydroxy-4,4-dimethylpentyl)-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-hydroxy-4,4-dimethyl-pentyl)-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-quinone Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4/c1-22(2,3)19(26)14-13-18-20(27)23(15-7-5-4-6-8-15)24(21(18)28)16-9-11-17(25)12-10-16/h4-12,18-19,25-26H,13-14H2,1-3H3