N-[1-dodecyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]-N-(5-oxidanylidenepyrazol-3-yl)benzamide

Systemtic Name: N-[1-dodecyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]-N-(5-oxidanylidenepyrazol-3-yl)benzamide Openeye Name: N-(1-dodecyl-2,5-dioxo-pyrrolidin-1-ium-1-yl)-N-(5-oxopyrazol-3-yl)benzamide CAS Name: N-(1-dodecyl-2,5-dioxo-1-pyrrolidin-1-iumyl)-N-(5-oxo-3-pyrazolyl)benzamide IUPAC Name: N-(1-dodecyl-2,5-dioxopyrrolidin-1-ium-1-yl)-N-(5-oxopyrazol-3-yl)benzamide Traditional Name: N-(2,5-diketo-1-lauryl-pyrrolidin-1-ium-1-yl)-N-(5-ketopyrazol-3-yl)benzamide Formula: C26H35N4O4+ MolecularWeight: 467.5805

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1(C(=O)CCC1=O)N(C2=CC(=O)N=N2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCC[N+]1(C(=O)CCC1=O)N(C2=CC(=O)N=N2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H35N4O4/c1-2-3-4-5-6-7-8-9-10-14-19-30(24(32)17-18-25(30)33)29(22-20-23(31)28-27-22)26(34)21-15-12-11-13-16-21/h11-13,15-16,20H,2-10,14,17-19H2,1H3/q+1