1-[4-(aminomethyl)-3-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-2-yl]-2-bromanyl-ethanone; phosphoric acid

Systemtic Name: 1-[4-(aminomethyl)-3-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-2-yl]-2-bromanyl-ethanone; phosphoric acid Openeye Name: 1-[4-(aminomethyl)-5-hydroxy-3-(hydroxymethyl)-6-methyl-2-pyridyl]-2-bromo-ethanone; phosphoric acid CAS Name: 1-[4-(aminomethyl)-5-hydroxy-3-(hydroxymethyl)-6-methyl-2-pyridinyl]-2-bromoethanone; phosphoric acid IUPAC Name: 1-[4-(aminomethyl)-5-hydroxy-3-(hydroxymethyl)-6-methylpyridin-2-yl]-2-bromoethanone; phosphoric acid Traditional Name: 1-[4-(aminomethyl)-5-hydroxy-6-methyl-3-methylol-2-pyridyl]-2-bromo-ethanone; phosphoric acid Formula: C10H16BrN2O7P MolecularWeight: 387.121001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C(=O)CBr)CO)CN)O.OP(=O)(O)O

Isomeric SMILES

CC1=C(C(=C(C(=N1)C(=O)CBr)CO)CN)O.OP(=O)(O)O

InChI

InChI=1S/C10H13BrN2O3.H3O4P/c1-5-10(16)6(3-12)7(4-14)9(13-5)8(15)2-11;1-5(2,3)4/h14,16H,2-4,12H2,1H3;(H3,1,2,3,4)