(2S)-N-(2-bromophenyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: (2S)-N-(2-bromophenyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: (2S)-N-(2-bromophenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: (2S)-N-(2-bromophenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: (2S)-N-(2-bromophenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: (2S)-N-(2-bromophenyl)-2-(4-keto-1,2,3-benzotriazin-3-yl)propionamide Formula: C16H13BrN4O2 MolecularWeight: 373.20402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1Br)N2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1Br)N2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H13BrN4O2/c1-10(15(22)18-14-9-5-3-7-12(14)17)21-16(23)11-6-2-4-8-13(11)19-20-21/h2-10H,1H3,(H,18,22)/t10-/m0/s1