4-butyl-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-dione hydrate

Systemtic Name: 4-butyl-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-dione hydrate Openeye Name: 4-butyl-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-dione hydrate CAS Name: 4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione hydrate IUPAC Name: 4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione hydrate Traditional Name: 4-butyl-1-(4-hydroxyphenyl)-2-phenyl-pyrazolidine-3,5-quinone hydrate Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3.O

Isomeric SMILES

CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3.O

InChI

InChI=1S/C19H20N2O3.H2O/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15;/h4-8,10-13,17,22H,2-3,9H2,1H3;1H2