3-(2,3-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-(2,3-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(2,3-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propanamide CAS Name: 3-(2,3-dimethoxyphenyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]propanamide IUPAC Name: 3-(2,3-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Traditional Name: 3-(2,3-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propionamide Formula: C21H29N4O3+ MolecularWeight: 385.47996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O3/c1-24-11-13-25(14-12-24)19-9-8-17(15-22-19)23-20(26)10-7-16-5-4-6-18(27-2)21(16)28-3/h4-6,8-9,15H,7,10-14H2,1-3H3,(H,23,26)/p+1