4-bromanyl-1-[3-(methylamino)-2-oxidanyl-propyl]indole-2,3-dione

Systemtic Name: 4-bromanyl-1-[3-(methylamino)-2-oxidanyl-propyl]indole-2,3-dione Openeye Name: 4-bromo-1-[2-hydroxy-3-(methylamino)propyl]indoline-2,3-dione CAS Name: 4-bromo-1-[2-hydroxy-3-(methylamino)propyl]indole-2,3-dione IUPAC Name: 4-bromo-1-[2-hydroxy-3-(methylamino)propyl]indole-2,3-dione Traditional Name: 4-bromo-1-[2-hydroxy-3-(methylamino)propyl]isatin Formula: C12H13BrN2O3 MolecularWeight: 313.14722

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(CN1C2=C(C(=CC=C2)Br)C(=O)C1=O)O

Isomeric SMILES

CNCC(CN1C2=C(C(=CC=C2)Br)C(=O)C1=O)O

InChI

InChI=1S/C12H13BrN2O3/c1-14-5-7(16)6-15-9-4-2-3-8(13)10(9)11(17)12(15)18/h2-4,7,14,16H,5-6H2,1H3