(3S)-N'-(5-nitro-2-oxidanylidene-indol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: (3S)-N'-(5-nitro-2-oxidanylidene-indol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: (3S)-N'-(5-nitro-2-oxo-indol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: (3S)-N'-(5-nitro-2-oxo-3-indolyl)-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: (3S)-N'-(5-nitro-2-oxoindol-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: (3S)-N'-(2-keto-5-nitro-indol-3-yl)-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C17H12N4O6 MolecularWeight: 368.30038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NNC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-]

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)NNC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O6/c22-16(14-8-26-12-3-1-2-4-13(12)27-14)20-19-15-10-7-9(21(24)25)5-6-11(10)18-17(15)23/h1-7,14H,8H2,(H,20,22)(H,18,19,23)/t14-/m0/s1