1-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol

Systemtic Name: 1-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol Openeye Name: 1-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol CAS Name: 1-[[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol Traditional Name: 1-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]-2-naphthol Formula: C20H23N3O+2 MolecularWeight: 321.41612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=CC=CC=C32)O)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=CC=CC=C32)O)C4=CC=CC=[NH+]4

InChI

InChI=1S/C20H21N3O/c24-19-9-8-16-5-1-2-6-17(16)18(19)15-22-11-13-23(14-12-22)20-7-3-4-10-21-20/h1-10,24H,11-15H2/p+2