3-chloranyl-4-(3-chloranyl-2-nitro-phenyl)-1H-pyrrole; (3E,5E)-6-oxidanyl-2-oxidanylidene-6-phenyl-hexa-3,5-dienoic acid

Systemtic Name: 3-chloranyl-4-(3-chloranyl-2-nitro-phenyl)-1H-pyrrole; (3E,5E)-6-oxidanyl-2-oxidanylidene-6-phenyl-hexa-3,5-dienoic acid Openeye Name: 3-chloro-4-(3-chloro-2-nitro-phenyl)-1H-pyrrole; (3E,5E)-6-hydroxy-2-oxo-6-phenyl-hexa-3,5-dienoic acid CAS Name: 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole; (3E,5E)-6-hydroxy-2-oxo-6-phenylhexa-3,5-dienoic acid IUPAC Name: 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole; (3E,5E)-6-hydroxy-2-oxo-6-phenylhexa-3,5-dienoic acid Traditional Name: 3-chloro-4-(3-chloro-2-nitro-phenyl)-1H-pyrrole; (3E,5E)-6-hydroxy-2-keto-6-phenyl-hexa-3,5-dienoic acid Formula: C22H16Cl2N2O6 MolecularWeight: 475.27824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC=CC(=O)C(=O)O)O.C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C=C\C(=O)C(=O)O)/O.C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

InChI

InChI=1S/C12H10O4.C10H6Cl2N2O2/c13-10(9-5-2-1-3-6-9)7-4-8-11(14)12(15)16;11-8-3-1-2-6(10(8)14(15)16)7-4-13-5-9(7)12/h1-8,13H,(H,15,16);1-5,13H/b8-4+,10-7+;