butanedioic acid; 4-butyl-4-(hydroxymethyl)-1,2-diphenyl-pyrazolidine-3,5-dione

Systemtic Name: butanedioic acid; 4-butyl-4-(hydroxymethyl)-1,2-diphenyl-pyrazolidine-3,5-dione Openeye Name: 4-butyl-4-(hydroxymethyl)-1,2-diphenyl-pyrazolidine-3,5-dione; succinic acid CAS Name: butanedioic acid; 4-butyl-4-(hydroxymethyl)-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: butanedioic acid; 4-butyl-4-(hydroxymethyl)-1,2-diphenylpyrazolidine-3,5-dione Traditional Name: 4-butyl-4-methylol-1,2-diphenyl-pyrazolidine-3,5-quinone; succinic acid Formula: C24H28N2O7 MolecularWeight: 456.48832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CO.C(CC(=O)O)C(=O)O

Isomeric SMILES

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CO.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C20H22N2O3.C4H6O4/c1-2-3-14-20(15-23)18(24)21(16-10-6-4-7-11-16)22(19(20)25)17-12-8-5-9-13-17;5-3(6)1-2-4(7)8/h4-13,23H,2-3,14-15H2,1H3;1-2H2,(H,5,6)(H,7,8)