[(3S)-5-bromanyl-2-oxidanylidene-1,3-dihydroindol-3-yl]-phenethyl-azanium

Systemtic Name: [(3S)-5-bromanyl-2-oxidanylidene-1,3-dihydroindol-3-yl]-phenethyl-azanium Openeye Name: [(3S)-5-bromo-2-oxo-indolin-3-yl]-phenethyl-ammonium CAS Name: [(3S)-5-bromo-2-oxo-1,3-dihydroindol-3-yl]-phenethylammonium IUPAC Name: [(3S)-5-bromo-2-oxo-1,3-dihydroindol-3-yl]-phenethylazanium Traditional Name: [(3S)-5-bromo-2-keto-indolin-3-yl]-phenethyl-ammonium Formula: C16H16BrN2O+ MolecularWeight: 332.21504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH2+]C2C3=C(C=CC(=C3)Br)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CC[NH2+][C@H]2C3=C(C=CC(=C3)Br)NC2=O

InChI

InChI=1S/C16H15BrN2O/c17-12-6-7-14-13(10-12)15(16(20)19-14)18-9-8-11-4-2-1-3-5-11/h1-7,10,15,18H,8-9H2,(H,19,20)/p+1/t15-/m0/s1