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

Systemtic Name: 3-(2-methylphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Openeye Name: 3-(2-methylphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide CAS Name: 3-(2-methylphenoxy)-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-(2-methylphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Traditional Name: 3-(2-methylphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propionamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2/c1-17-5-3-4-6-20(17)26-16-11-21(25)22-18-7-9-19(10-8-18)24-14-12-23(2)13-15-24/h3-10H,11-16H2,1-2H3,(H,22,25)/p+1