(2S)-N-(1,3-benzodioxol-5-yl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-(4-keto-1,2,3-benzotriazin-3-yl)propionamide Formula: C17H14N4O4 MolecularWeight: 338.31746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=C(C=C1)OCO2)N3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H14N4O4/c1-10(21-17(23)12-4-2-3-5-13(12)19-20-21)16(22)18-11-6-7-14-15(8-11)25-9-24-14/h2-8,10H,9H2,1H3,(H,18,22)/t10-/m0/s1