4-butyl-4-[(3-nitrophenyl)methyl]-1,2-diphenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-butyl-4-[(3-nitrophenyl)methyl]-1,2-diphenyl-pyrazolidine-3,5-dione Openeye Name: 4-butyl-4-[(3-nitrophenyl)methyl]-1,2-diphenyl-pyrazolidine-3,5-dione CAS Name: 4-butyl-4-[(3-nitrophenyl)methyl]-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: 4-butyl-4-[(3-nitrophenyl)methyl]-1,2-diphenylpyrazolidine-3,5-dione Traditional Name: 4-butyl-4-(3-nitrobenzyl)-1,2-diphenyl-pyrazolidine-3,5-quinone Formula: C26H25N3O4 MolecularWeight: 443.4944

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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)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H25N3O4/c1-2-3-17-26(19-20-11-10-16-23(18-20)29(32)33)24(30)27(21-12-6-4-7-13-21)28(25(26)31)22-14-8-5-9-15-22/h4-16,18H,2-3,17,19H2,1H3