3-(2-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide

Systemtic Name: 3-(2-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: 3-(2-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: 3-(2-methylphenoxy)-N-[4-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-(2-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: 3-(2-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propionamide Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)NC2=CC=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)NC2=CC=C(C=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C20H25N3O2/c1-16-4-2-3-5-19(16)25-15-10-20(24)22-17-6-8-18(9-7-17)23-13-11-21-12-14-23/h2-9,21H,10-15H2,1H3,(H,22,24)/p+1