3-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]-N-methyl-benzamide Openeye Name: 3-[[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N-methyl-benzamide CAS Name: 3-[[2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 3-[[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N-methylbenzamide Traditional Name: N-methyl-3-[[2-(4-o-phenetylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Formula: C22H29N4O3+ MolecularWeight: 397.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C(=O)NC

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C(=O)NC

InChI

InChI=1S/C22H28N4O3/c1-3-29-20-10-5-4-9-19(20)26-13-11-25(12-14-26)16-21(27)24-18-8-6-7-17(15-18)22(28)23-2/h4-10,15H,3,11-14,16H2,1-2H3,(H,23,28)(H,24,27)/p+1