N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C26H29ClN3O4+ MolecularWeight: 482.97916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C26H28ClN3O4/c1-2-33-22-8-10-23(11-9-22)34-25-12-3-19(27)17-24(25)28-26(32)18-29-13-15-30(16-14-29)20-4-6-21(31)7-5-20/h3-12,17,31H,2,13-16,18H2,1H3,(H,28,32)/p+1