N-ethyl-3-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-ethyl-3-[[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-ethyl-3-[[2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-ethyl-3-[[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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