4-[3-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanoylamino]benzamide

Systemtic Name: 4-[3-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanoylamino]benzamide Openeye Name: 4-[3-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanoylamino]benzamide CAS Name: 4-[[3-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanoylamino]benzamide Traditional Name: 4-[3-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanoylamino]benzamide Formula: C20H25N4O3+ MolecularWeight: 369.4375

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC=C(C=C2)C(=O)N)C3=CC=C(C=C3)O

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC=C(C=C2)C(=O)N)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H24N4O3/c21-20(27)15-1-3-16(4-2-15)22-19(26)9-10-23-11-13-24(14-12-23)17-5-7-18(25)8-6-17/h1-8,25H,9-14H2,(H2,21,27)(H,22,26)/p+1