7-bromanyl-1-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]indole-2,3-dione

Systemtic Name: 7-bromanyl-1-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]indole-2,3-dione Openeye Name: 7-bromo-1-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]indoline-2,3-dione CAS Name: 7-bromo-1-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]indole-2,3-dione IUPAC Name: 7-bromo-1-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]indole-2,3-dione Traditional Name: 7-bromo-1-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]isatin Formula: C16H20BrN2O2+ MolecularWeight: 352.2462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CN2C3=C(C=CC=C3Br)C(=O)C2=O

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CN2C3=C(C=CC=C3Br)C(=O)C2=O

InChI

InChI=1S/C16H19BrN2O2/c1-2-11-6-3-4-9-18(11)10-19-14-12(15(20)16(19)21)7-5-8-13(14)17/h5,7-8,11H,2-4,6,9-10H2,1H3/p+1/t11-/m0/s1