3-[(2-bromophenyl)amino]-4-[(4-nitro-2-oxidanyl-phenyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(2-bromophenyl)amino]-4-[(4-nitro-2-oxidanyl-phenyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(2-bromoanilino)-4-(2-hydroxy-4-nitro-anilino)cyclobut-3-ene-1,2-dione CAS Name: 3-(2-bromoanilino)-4-(2-hydroxy-4-nitroanilino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(2-bromoanilino)-4-(2-hydroxy-4-nitroanilino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(2-bromoanilino)-4-(2-hydroxy-4-nitro-anilino)cyclobut-3-ene-1,2-quinone Formula: C16H10BrN3O5 MolecularWeight: 404.1717

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C(=O)C2=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C(=O)C2=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O)Br

InChI

InChI=1S/C16H10BrN3O5/c17-9-3-1-2-4-10(9)18-13-14(16(23)15(13)22)19-11-6-5-8(20(24)25)7-12(11)21/h1-7,18-19,21H