calcium 4-butyl-1,2-diphenyl-pyrazolidine-3,5-dione

Systemtic Name: calcium 4-butyl-1,2-diphenyl-pyrazolidine-3,5-dione Openeye Name: calcium 4-butyl-1,2-diphenyl-pyrazolidine-3,5-dione CAS Name: calcium 4-butyl-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: calcium 4-butyl-1,2-diphenylpyrazolidine-3,5-dione Traditional Name: calcium 4-butyl-1,2-diphenyl-pyrazolidine-3,5-quinone Formula: C19H20CaN2O2+2 MolecularWeight: 348.4523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.[Ca+2]

Isomeric SMILES

CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.[Ca+2]

InChI

InChI=1S/C19H20N2O2.Ca/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16;/h4-13,17H,2-3,14H2,1H3;/q;+2