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

Systemtic Name: 4-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-(4-o-phenetylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c1-2-28-19-6-4-3-5-18(19)25-13-11-24(12-14-25)15-20(26)23-17-9-7-16(8-10-17)21(22)27/h3-10H,2,11-15H2,1H3,(H2,22,27)(H,23,26)/p+1