4-(2-ethoxyphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide

Systemtic Name: 4-(2-ethoxyphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide Openeye Name: 4-(2-ethoxyphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide CAS Name: 4-(2-ethoxyphenoxy)-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]butanamide IUPAC Name: 4-(2-ethoxyphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide Traditional Name: 4-(2-ethoxyphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]butyramide Formula: C23H32N3O3+ MolecularWeight: 398.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C23H31N3O3/c1-3-28-21-7-4-5-8-22(21)29-18-6-9-23(27)24-19-10-12-20(13-11-19)26-16-14-25(2)15-17-26/h4-5,7-8,10-13H,3,6,9,14-18H2,1-2H3,(H,24,27)/p+1