N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazin-1-ium-1-yl]acetamide Formula: C24H36N5O3+ MolecularWeight: 442.57434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CC[NH+](CC2)CC(=O)NC3=CC=NN3C4CCCC4)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CC[NH+](CC2)CC(=O)NC3=CC=NN3C4CCCC4)OC)OC

InChI

InChI=1S/C24H35N5O3/c1-18-14-21(31-2)22(32-3)15-19(18)16-27-10-12-28(13-11-27)17-24(30)26-23-8-9-25-29(23)20-6-4-5-7-20/h8-9,14-15,20H,4-7,10-13,16-17H2,1-3H3,(H,26,30)/p+1