2-bromanyl-6-methoxy-4-(piperidin-1-ium-1-ylmethyl)phenol

Systemtic Name: 2-bromanyl-6-methoxy-4-(piperidin-1-ium-1-ylmethyl)phenol Openeye Name: 2-bromo-6-methoxy-4-(piperidin-1-ium-1-ylmethyl)phenol CAS Name: 2-bromo-6-methoxy-4-(1-piperidin-1-iumylmethyl)phenol IUPAC Name: 2-bromo-6-methoxy-4-(piperidin-1-ium-1-ylmethyl)phenol Traditional Name: 2-bromo-6-methoxy-4-(piperidin-1-ium-1-ylmethyl)phenol Formula: C13H19BrNO2+ MolecularWeight: 301.19946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH+]2CCCCC2)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH+]2CCCCC2)Br)O

InChI

InChI=1S/C13H18BrNO2/c1-17-12-8-10(7-11(14)13(12)16)9-15-5-3-2-4-6-15/h7-8,16H,2-6,9H2,1H3/p+1