2-[4-(4-morpholin-4-ylbutyl)piperazin-4-ium-1-yl]phenol

Systemtic Name: 2-[4-(4-morpholin-4-ylbutyl)piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-(4-morpholinobutyl)piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[4-(4-morpholinyl)butyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-(4-morpholin-4-ylbutyl)piperazin-4-ium-1-yl]phenol Traditional Name: 2-[4-(4-morpholinobutyl)piperazin-4-ium-1-yl]phenol Formula: C18H30N3O2+ MolecularWeight: 320.4497

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCCN2CCOCC2)C3=CC=CC=C3O

Isomeric SMILES

C1CN(CC[NH+]1CCCCN2CCOCC2)C3=CC=CC=C3O

InChI

InChI=1S/C18H29N3O2/c22-18-6-2-1-5-17(18)21-11-9-19(10-12-21)7-3-4-8-20-13-15-23-16-14-20/h1-2,5-6,22H,3-4,7-16H2/p+1