(3S,3aR,6aS)-3-(3-nitrophenyl)-5-[4-[oxidanidyl(oxidanyl)amino]phenyl]-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

Systemtic Name: (3S,3aR,6aS)-3-(3-nitrophenyl)-5-[4-[oxidanidyl(oxidanyl)amino]phenyl]-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione Openeye Name: (3S,3aR,6aS)-5-[4-[hydroxy(oxido)amino]phenyl]-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione CAS Name: (3S,3aR,6aS)-5-[4-[hydroxy(oxido)amino]phenyl]-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione IUPAC Name: (3S,3aR,6aS)-5-[4-[hydroxy(oxido)amino]phenyl]-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione Traditional Name: (3S,3aR,6aS)-5-[4-[hydroxy(oxido)amino]phenyl]-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrol[3,4-d]isoxazole-4,6-quinone Formula: C23H17N4O7- MolecularWeight: 461.40368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)N(O)[O-])C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2[C@@H]([C@@H]3[C@H](O2)C(=O)N(C3=O)C4=CC=C(C=C4)N(O)[O-])C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H17N4O7/c28-22-19-20(14-5-4-8-18(13-14)27(32)33)25(16-6-2-1-3-7-16)34-21(19)23(29)24(22)15-9-11-17(12-10-15)26(30)31/h1-13,19-21,30H/q-1/t19-,20-,21+/m1/s1