(3E)-7-chloranyl-3-[(4-nitrophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-7-chloranyl-3-[(4-nitrophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-7-chloro-3-[(4-nitrophenyl)methylene]-5-phenyl-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-7-chloro-3-[(4-nitrophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-7-chloro-3-[(4-nitrophenyl)methylidene]-5-phenyl-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-7-chloro-3-(4-nitrobenzylidene)-5-phenyl-4H-1,4-benzodiazepin-2-one Formula: C22H14ClN3O3 MolecularWeight: 403.81786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)C(=CC4=CC=C(C=C4)[N+](=O)[O-])N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)/C(=C\C4=CC=C(C=C4)[N+](=O)[O-])/N2)Cl

InChI

InChI=1S/C22H14ClN3O3/c23-16-8-11-19-18(13-16)21(15-4-2-1-3-5-15)24-20(22(27)25-19)12-14-6-9-17(10-7-14)26(28)29/h1-13,24H/b20-12+