(2R)-N-(1,3-benzodioxol-5-yl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-keto-1,2,3-benzotriazin-3-yl)butyramide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O4/c1-2-14(22-18(24)12-5-3-4-6-13(12)20-21-22)17(23)19-11-7-8-15-16(9-11)26-10-25-15/h3-9,14H,2,10H2,1H3,(H,19,23)/t14-/m1/s1