2-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethyl]propanamide

Systemtic Name: 2-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethyl]propanamide Openeye Name: 2-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)ethyl]propanamide CAS Name: 2-methyl-N-[2-(4-phenyl-1-piperazin-1-iumyl)-2-(3-pyridinyl)ethyl]propanamide IUPAC Name: 2-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-ylethyl]propanamide Traditional Name: 2-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)ethyl]propionamide Formula: C21H29N4O+ MolecularWeight: 353.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC(C1=CN=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NCC(C1=CN=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O/c1-17(2)21(26)23-16-20(18-7-6-10-22-15-18)25-13-11-24(12-14-25)19-8-4-3-5-9-19/h3-10,15,17,20H,11-14,16H2,1-2H3,(H,23,26)/p+1