N-[4-[2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanoylamino]-2,5-dimethoxy-phenyl]benzamide

Systemtic Name: N-[4-[2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanoylamino]-2,5-dimethoxy-phenyl]benzamide Openeye Name: N-[4-[[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetyl]amino]-2,5-dimethoxy-phenyl]benzamide CAS Name: N-[4-[[2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]-2,5-dimethoxyphenyl]benzamide IUPAC Name: N-[4-[[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetyl]amino]-2,5-dimethoxyphenyl]benzamide Traditional Name: N-[4-[[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetyl]amino]-2,5-dimethoxy-phenyl]benzamide Formula: C25H31N4O5+ MolecularWeight: 467.53744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C25H30N4O5/c1-33-21-15-20(27-24(31)17-6-4-3-5-7-17)22(34-2)14-19(21)26-23(30)16-28-10-12-29(13-11-28)25(32)18-8-9-18/h3-7,14-15,18H,8-13,16H2,1-2H3,(H,26,30)(H,27,31)/p+1