[(2S)-3-[4-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-[4-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(4-bromo-2,3-dioxo-indolin-1-yl)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(4-bromo-2,3-dioxo-1-indolyl)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(4-bromo-2,3-dioxoindol-1-yl)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(4-bromo-2,3-diketo-indolin-1-yl)-2-hydroxy-propyl]-methyl-ammonium Formula: C12H14BrN2O3+ MolecularWeight: 314.15516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CN1C2=C(C(=CC=C2)Br)C(=O)C1=O)O

Isomeric SMILES

C[NH2+]C[C@@H](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/p+1/t7-/m0/s1