3-(3-nitrophenyl)-4-oxidanidyl-1-phenylmethoxy-quinoxalin-4-ium-2-one

Systemtic Name: 3-(3-nitrophenyl)-4-oxidanidyl-1-phenylmethoxy-quinoxalin-4-ium-2-one Openeye Name: 1-benzyloxy-3-(3-nitrophenyl)-4-oxido-quinoxalin-4-ium-2-one CAS Name: 3-(3-nitrophenyl)-4-oxido-1-phenylmethoxy-2-quinoxalin-4-iumone IUPAC Name: 3-(3-nitrophenyl)-4-oxido-1-phenylmethoxyquinoxalin-4-ium-2-one Traditional Name: 1-benzoxy-3-(3-nitrophenyl)-4-oxido-quinoxalin-4-ium-2-one Formula: C21H15N3O5 MolecularWeight: 389.3609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CON2C3=CC=CC=C3[N+](=C(C2=O)C4=CC(=CC=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)CON2C3=CC=CC=C3[N+](=C(C2=O)C4=CC(=CC=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H15N3O5/c25-21-20(16-9-6-10-17(13-16)24(27)28)22(26)18-11-4-5-12-19(18)23(21)29-14-15-7-2-1-3-8-15/h1-13H,14H2