N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-ethoxyphenoxy)butanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-ethoxyphenoxy)butanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-ethoxyphenoxy)butanamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-(2-ethoxyphenoxy)butanamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-ethoxyphenoxy)butanamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-ethoxyphenoxy)butyramide Formula: C23H31ClN3O3+ MolecularWeight: 432.96354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30ClN3O3/c1-3-29-21-7-4-5-8-22(21)30-16-6-9-23(28)25-19-17-18(24)10-11-20(19)27-14-12-26(2)13-15-27/h4-5,7-8,10-11,17H,3,6,9,12-16H2,1-2H3,(H,25,28)/p+1