4-bromanyl-2-(3-pyridin-1-ium-3-yl-2,3-dihydro-1H-pyrazol-5-yl)phenol

Systemtic Name: 4-bromanyl-2-(3-pyridin-1-ium-3-yl-2,3-dihydro-1H-pyrazol-5-yl)phenol Openeye Name: 4-bromo-2-(3-pyridin-1-ium-3-yl-2,3-dihydro-1H-pyrazol-5-yl)phenol CAS Name: 4-bromo-2-[3-(3-pyridin-1-iumyl)-2,3-dihydro-1H-pyrazol-5-yl]phenol IUPAC Name: 4-bromo-2-(3-pyridin-1-ium-3-yl-2,3-dihydro-1H-pyrazol-5-yl)phenol Traditional Name: 4-bromo-2-(5-pyridin-1-ium-3-yl-3-pyrazolin-3-yl)phenol Formula: C14H13BrN3O+ MolecularWeight: 319.17652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)C2C=C(NN2)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1=CC(=C[NH+]=C1)C2C=C(NN2)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C14H12BrN3O/c15-10-3-4-14(19)11(6-10)13-7-12(17-18-13)9-2-1-5-16-8-9/h1-8,12,17-19H/p+1