N-(5-butyl-8-methyl-pyrazolo[1,5-a]pyrimidin-8-ium-6-yl)-3,4,5-trimethoxy-benzamide

Systemtic Name: N-(5-butyl-8-methyl-pyrazolo[1,5-a]pyrimidin-8-ium-6-yl)-3,4,5-trimethoxy-benzamide Openeye Name: N-(5-butyl-8-methyl-pyrazolo[1,5-a]pyrimidin-8-ium-6-yl)-3,4,5-trimethoxy-benzamide CAS Name: N-(5-butyl-8-methyl-6-pyrazolo[1,5-a]pyrimidin-8-iumyl)-3,4,5-trimethoxybenzamide IUPAC Name: N-(5-butyl-8-methylpyrazolo[1,5-a]pyrimidin-8-ium-6-yl)-3,4,5-trimethoxybenzamide Traditional Name: N-(5-butyl-8-methyl-pyrazolo[1,5-a]pyrimidin-8-ium-6-yl)-3,4,5-trimethoxy-benzamide Formula: C21H27N4O4+ MolecularWeight: 399.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=N[N+]2(C=C1NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C

Isomeric SMILES

CCCCC1=NC2=CC=N[N+]2(C=C1NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C

InChI

InChI=1S/C21H26N4O4/c1-6-7-8-15-16(13-25(2)19(23-15)9-10-22-25)24-21(26)14-11-17(27-3)20(29-5)18(12-14)28-4/h9-13H,6-8H2,1-5H3/p+1