5-(4-chlorophenyl)-3a-(4-nitrophenyl)-2,3-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione

Systemtic Name: 5-(4-chlorophenyl)-3a-(4-nitrophenyl)-2,3-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione Openeye Name: 5-(4-chlorophenyl)-3a-(4-nitrophenyl)-2,3-diphenyl-3,6a-dihydropyrrolo[3,4-d]isoxazole-4,6-dione CAS Name: 5-(4-chlorophenyl)-3a-(4-nitrophenyl)-2,3-diphenyl-3,6a-dihydropyrrolo[3,4-d]isoxazole-4,6-dione IUPAC Name: 5-(4-chlorophenyl)-3a-(4-nitrophenyl)-2,3-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione Traditional Name: 5-(4-chlorophenyl)-3a-(4-nitrophenyl)-2,3-diphenyl-3,6a-dihydropyrrol[3,4-d]isoxazole-4,6-quinone Formula: C29H20ClN3O5 MolecularWeight: 525.9392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C3(C(C(=O)N(C3=O)C4=CC=C(C=C4)Cl)ON2C5=CC=CC=C5)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2C3(C(C(=O)N(C3=O)C4=CC=C(C=C4)Cl)ON2C5=CC=CC=C5)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C29H20ClN3O5/c30-21-13-17-22(18-14-21)31-27(34)26-29(28(31)35,20-11-15-24(16-12-20)33(36)37)25(19-7-3-1-4-8-19)32(38-26)23-9-5-2-6-10-23/h1-18,25-26H