2-bromanyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-3-ol

Systemtic Name: 2-bromanyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-3-ol Openeye Name: 2-bromo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-3-ol CAS Name: 2-bromo-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-3-pyridinol IUPAC Name: 2-bromo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-3-ol Traditional Name: 2-bromo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-3-ol Formula: C16H19BrN3O+ MolecularWeight: 349.24556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrN3O/c17-16-15(21)13(6-7-18-16)12-19-8-10-20(11-9-19)14-4-2-1-3-5-14/h1-7,21H,8-12H2/p+1