N-[3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-2-methyl-benzamide

Systemtic Name: N-[3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-2-methyl-benzamide Openeye Name: N-[3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-oxo-propyl]-2-methyl-benzamide CAS Name: N-[3-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-3-oxopropyl]-2-methylbenzamide IUPAC Name: N-[3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-oxopropyl]-2-methylbenzamide Traditional Name: N-[3-keto-3-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]propyl]-2-methyl-benzamide Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31N3O4/c1-19-5-3-4-6-22(19)24(29)25-12-11-23(28)27-15-13-26(14-16-27)17-18-31-21-9-7-20(30-2)8-10-21/h3-10H,11-18H2,1-2H3,(H,25,29)/p+1