N-methyl-4-[2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-methyl-4-[2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-(4-benzoylpiperazin-1-ium-1-yl)acetyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-(4-benzoyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-(4-benzoylpiperazin-1-ium-1-yl)acetyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-(4-benzoylpiperazin-1-ium-1-yl)acetyl]amino]-N-methyl-benzamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3/c1-22-20(27)16-7-9-18(10-8-16)23-19(26)15-24-11-13-25(14-12-24)21(28)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H,22,27)(H,23,26)/p+1