3-[(4E)-3,5-bis(oxidanylidene)-4-(oxidanylmethylidene)pyrazolidin-1-yl]-N-octyl-benzamide

Systemtic Name: 3-[(4E)-3,5-bis(oxidanylidene)-4-(oxidanylmethylidene)pyrazolidin-1-yl]-N-octyl-benzamide Openeye Name: 3-[(4E)-4-(hydroxymethylene)-3,5-dioxo-pyrazolidin-1-yl]-N-octyl-benzamide CAS Name: 3-[(4E)-4-(hydroxymethylidene)-3,5-dioxo-1-pyrazolidinyl]-N-octylbenzamide IUPAC Name: 3-[(4E)-4-(hydroxymethylidene)-3,5-dioxopyrazolidin-1-yl]-N-octylbenzamide Traditional Name: 3-[(4E)-4-(hydroxymethylene)-3,5-diketo-pyrazolidin-1-yl]-N-octyl-benzamide Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=CC(=CC=C1)N2C(=O)C(=CO)C(=O)N2

Isomeric SMILES

CCCCCCCCNC(=O)C1=CC(=CC=C1)N2C(=O)/C(=C/O)/C(=O)N2

InChI

InChI=1S/C19H25N3O4/c1-2-3-4-5-6-7-11-20-17(24)14-9-8-10-15(12-14)22-19(26)16(13-23)18(25)21-22/h8-10,12-13,23H,2-7,11H2,1H3,(H,20,24)(H,21,25)/b16-13+