[(3S)-4-bromanyl-2-oxidanylidene-1,3-dihydroindol-3-yl]-butyl-azanium

Systemtic Name: [(3S)-4-bromanyl-2-oxidanylidene-1,3-dihydroindol-3-yl]-butyl-azanium Openeye Name: [(3S)-4-bromo-2-oxo-indolin-3-yl]-butyl-ammonium CAS Name: [(3S)-4-bromo-2-oxo-1,3-dihydroindol-3-yl]-butylammonium IUPAC Name: [(3S)-4-bromo-2-oxo-1,3-dihydroindol-3-yl]-butylazanium Traditional Name: [(3S)-4-bromo-2-keto-indolin-3-yl]-butyl-ammonium Formula: C12H16BrN2O+ MolecularWeight: 284.17224

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C1C2=C(C=CC=C2Br)NC1=O

Isomeric SMILES

CCCC[NH2+][C@H]1C2=C(C=CC=C2Br)NC1=O

InChI

InChI=1S/C12H15BrN2O/c1-2-3-7-14-11-10-8(13)5-4-6-9(10)15-12(11)16/h4-6,11,14H,2-3,7H2,1H3,(H,15,16)/p+1/t11-/m0/s1