3-[4-(2,3-dihydroindol-1-yl)-3-nitro-phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[4-(2,3-dihydroindol-1-yl)-3-nitro-phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-(4-indolin-1-yl-3-nitro-phenyl)-2H-oxadiazol-3-ium-5-one CAS Name: 3-[4-(2,3-dihydroindol-1-yl)-3-nitrophenyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[4-(2,3-dihydroindol-1-yl)-3-nitrophenyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 3-(4-indolin-1-yl-3-nitro-phenyl)-2H-oxadiazol-3-ium-5-one Formula: C16H13N4O4+ MolecularWeight: 325.29882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=C(C=C(C=C3)[N+]4=CC(=O)ON4)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=C(C=C(C=C3)[N+]4=CC(=O)ON4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4/c21-16-10-19(17-24-16)12-5-6-14(15(9-12)20(22)23)18-8-7-11-3-1-2-4-13(11)18/h1-6,9-10H,7-8H2/p+1