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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propanamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]propanamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Traditional Name: 3-(3,4-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=CC(=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

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