3-(3-methoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-(3-methoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(3-methoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propanamide CAS Name: 3-(3-methoxyphenyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]propanamide IUPAC Name: 3-(3-methoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Traditional Name: 3-(3-methoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propionamide Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCC3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H26N4O2/c1-23-10-12-24(13-11-23)19-8-7-17(15-21-19)22-20(25)9-6-16-4-3-5-18(14-16)26-2/h3-5,7-8,14-15H,6,9-13H2,1-2H3,(H,22,25)/p+1