N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]quinoline-5-carboxamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]quinoline-5-carboxamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]quinoline-5-carboxamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-5-quinolinecarboxamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]quinoline-5-carboxamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]quinoline-5-carboxamide Formula: C22H25N4O+ MolecularWeight: 361.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=C3C=CC=NC3=CC=C2)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=C3C=CC=NC3=CC=C2)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O/c27-22(20-8-4-10-21-19(20)9-5-11-23-21)24-12-13-25-14-16-26(17-15-25)18-6-2-1-3-7-18/h1-11H,12-17H2,(H,24,27)/p+1