4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol

Systemtic Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Openeye Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol CAS Name: 4-[(4-phenyl-1-piperazin-1-iumyl)methyl]phenol IUPAC Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Traditional Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Formula: C17H21N2O+ MolecularWeight: 269.36144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)O)C3=CC=CC=C3

InChI

InChI=1S/C17H20N2O/c20-17-8-6-15(7-9-17)14-18-10-12-19(13-11-18)16-4-2-1-3-5-16/h1-9,20H,10-14H2/p+1