(4Z)-1-(3-chloranyl-4-methyl-phenyl)-4-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: (4Z)-1-(3-chloranyl-4-methyl-phenyl)-4-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]pyrazolidine-3,5-dione Openeye Name: (4Z)-1-(3-chloro-4-methyl-phenyl)-4-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]pyrazolidine-3,5-dione CAS Name: (4Z)-1-(3-chloro-4-methylphenyl)-4-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]pyrazolidine-3,5-dione IUPAC Name: (4Z)-1-(3-chloro-4-methylphenyl)-4-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]pyrazolidine-3,5-dione Traditional Name: (4Z)-1-(3-chloro-4-methyl-phenyl)-4-(4-hydroxy-3-methoxy-5-nitro-benzylidene)pyrazolidine-3,5-quinone Formula: C18H14ClN3O6 MolecularWeight: 403.77326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])C(=O)N2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C\C3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])/C(=O)N2)Cl

InChI

InChI=1S/C18H14ClN3O6/c1-9-3-4-11(8-13(9)19)21-18(25)12(17(24)20-21)5-10-6-14(22(26)27)16(23)15(7-10)28-2/h3-8,23H,1-2H3,(H,20,24)/b12-5-