5-ethanoyl-1-(4-hydroxyphenyl)-4-(3-oxidanylidenebutyl)-2-phenyl-pyrazolidin-3-one

Systemtic Name: 5-ethanoyl-1-(4-hydroxyphenyl)-4-(3-oxidanylidenebutyl)-2-phenyl-pyrazolidin-3-one Openeye Name: 5-acetyl-1-(4-hydroxyphenyl)-4-(3-oxobutyl)-2-phenyl-pyrazolidin-3-one CAS Name: 5-acetyl-1-(4-hydroxyphenyl)-4-(3-oxobutyl)-2-phenyl-3-pyrazolidinone IUPAC Name: 5-acetyl-1-(4-hydroxyphenyl)-4-(3-oxobutyl)-2-phenylpyrazolidin-3-one Traditional Name: 5-acetyl-1-(4-hydroxyphenyl)-4-(3-ketobutyl)-2-phenyl-pyrazolidin-3-one Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4/c1-14(24)8-13-19-20(15(2)25)22(17-9-11-18(26)12-10-17)23(21(19)27)16-6-4-3-5-7-16/h3-7,9-12,19-20,26H,8,13H2,1-2H3