5-bromanyl-1-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]indole-2,3-dione Openeye Name: 5-bromo-1-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]indoline-2,3-dione CAS Name: 5-bromo-1-[[(2S)-2-methyl-4-morpholin-4-iumyl]methyl]indole-2,3-dione IUPAC Name: 5-bromo-1-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]indole-2,3-dione Traditional Name: 5-bromo-1-[[(2S)-2-methylmorpholin-4-ium-4-yl]methyl]isatin Formula: C14H16BrN2O3+ MolecularWeight: 340.19244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCO1)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

C[C@H]1C[NH+](CCO1)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C14H15BrN2O3/c1-9-7-16(4-5-20-9)8-17-12-3-2-10(15)6-11(12)13(18)14(17)19/h2-3,6,9H,4-5,7-8H2,1H3/p+1/t9-/m0/s1