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

Systemtic Name: 3-(3-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: 3-(3-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: 3-(3-methylphenoxy)-N-[4-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-(3-methylphenoxy)-N-(4-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: 3-(3-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=C1)OCCC(=O)NC2=CC=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)NC2=CC=C(C=C2)N3CC[NH2+]CC3

InChI

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