3-[(5-nitro-2-oxidanyl-phenyl)amino]-4-phenylazanyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(5-nitro-2-oxidanyl-phenyl)amino]-4-phenylazanyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-anilino-4-(2-hydroxy-5-nitro-anilino)cyclobut-3-ene-1,2-dione CAS Name: 3-anilino-4-(2-hydroxy-5-nitroanilino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-anilino-4-(2-hydroxy-5-nitroanilino)cyclobut-3-ene-1,2-dione Traditional Name: 3-anilino-4-(2-hydroxy-5-nitro-anilino)cyclobut-3-ene-1,2-quinone Formula: C16H11N3O5 MolecularWeight: 325.27564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11N3O5/c20-12-7-6-10(19(23)24)8-11(12)18-14-13(15(21)16(14)22)17-9-4-2-1-3-5-9/h1-8,17-18,20H