[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-quinolin-5-yl-methanone

Systemtic Name: [4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-quinolin-5-yl-methanone Openeye Name: [4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-(5-quinolyl)methanone CAS Name: [4-(2-phenoxyethyl)-1-piperazin-4-iumyl]-(5-quinolinyl)methanone IUPAC Name: [4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-quinolin-5-ylmethanone Traditional Name: [4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-(5-quinolyl)methanone Formula: C22H24N3O2+ MolecularWeight: 362.44486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=C4C=CC=NC4=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=C4C=CC=NC4=CC=C3

InChI

InChI=1S/C22H23N3O2/c26-22(20-8-4-10-21-19(20)9-5-11-23-21)25-14-12-24(13-15-25)16-17-27-18-6-2-1-3-7-18/h1-11H,12-17H2/p+1