N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-(1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-pyrrolidino-nicotinamide Formula: C22H30N5O+ MolecularWeight: 380.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)N4CCCC4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)N4CCCC4

InChI

InChI=1S/C22H29N5O/c1-2-25-14-16-26(17-15-25)19-9-7-18(8-10-19)24-22(28)20-6-5-11-23-21(20)27-12-3-4-13-27/h5-11H,2-4,12-17H2,1H3,(H,24,28)/p+1