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

Systemtic Name: 3-(1H-indol-3-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(1H-indol-3-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propanamide CAS Name: 3-(1H-indol-3-yl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]propanamide IUPAC Name: 3-(1H-indol-3-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Traditional Name: 3-(1H-indol-3-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propionamide Formula: C21H26N5O+ MolecularWeight: 364.46404

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H25N5O/c1-25-10-12-26(13-11-25)20-8-7-17(15-23-20)24-21(27)9-6-16-14-22-19-5-3-2-4-18(16)19/h2-5,7-8,14-15,22H,6,9-13H2,1H3,(H,24,27)/p+1