N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-methylphenoxy)propanamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-methylphenoxy)propanamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-methylphenoxy)propanamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-(2-methylphenoxy)propanamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-methylphenoxy)propanamide Traditional Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-methylphenoxy)propionamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C22H29N3O2/c1-17-6-4-5-7-21(17)27-15-10-22(26)23-20-9-8-19(16-18(20)2)25-13-11-24(3)12-14-25/h4-9,16H,10-15H2,1-3H3,(H,23,26)/p+1