5-bromanyl-1-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]indole-2,3-dione Openeye Name: 5-bromo-1-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]indoline-2,3-dione CAS Name: 5-bromo-1-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]indole-2,3-dione IUPAC Name: 5-bromo-1-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]indole-2,3-dione Traditional Name: 5-bromo-1-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]isatin Formula: C14H16BrN2O3+ MolecularWeight: 340.19244

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O)O

Isomeric SMILES

C1C[C@H](C[NH+](C1)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O)O

InChI

InChI=1S/C14H15BrN2O3/c15-9-3-4-12-11(6-9)13(19)14(20)17(12)8-16-5-1-2-10(18)7-16/h3-4,6,10,18H,1-2,5,7-8H2/p+1/t10-/m1/s1