4-[[3-chloranyl-4-(naphthalen-1-ylmethoxy)-5-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[3-chloranyl-4-(naphthalen-1-ylmethoxy)-5-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-chloro-4-(1-naphthylmethoxy)-5-nitro-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-chloro-4-(1-naphthalenylmethoxy)-5-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-chloro-4-(naphthalen-1-ylmethoxy)-5-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[3-chloro-4-(1-naphthylmethoxy)-5-nitro-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C27H18ClN3O5 MolecularWeight: 499.90192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC4=CC=CC5=CC=CC=C54)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC4=CC=CC5=CC=CC=C54)[N+](=O)[O-])C(=O)N2

InChI

InChI=1S/C27H18ClN3O5/c28-23-14-17(13-22-26(32)29-30(27(22)33)20-10-2-1-3-11-20)15-24(31(34)35)25(23)36-16-19-9-6-8-18-7-4-5-12-21(18)19/h1-15H,16H2,(H,29,32)