2-[2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanoylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanoylamino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetyl]amino]-N-(m-tolyl)benzamide Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H28N4O3/c1-17-5-4-6-19(15-17)25-23(30)20-7-2-3-8-21(20)26-22(29)16-27-11-13-28(14-12-27)24(31)18-9-10-18/h2-8,15,18H,9-14,16H2,1H3,(H,25,30)(H,26,29)/p+1