(5E)-2-azanyl-5-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-1,3-thiazol-4-one

Systemtic Name: (5E)-2-azanyl-5-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-1,3-thiazol-4-one Openeye Name: (5E)-2-amino-5-[[3-(2,4-dinitrophenoxy)phenyl]methylene]thiazol-4-one CAS Name: (5E)-2-amino-5-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-4-thiazolone IUPAC Name: (5E)-2-amino-5-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-amino-5-[3-(2,4-dinitrophenoxy)benzylidene]-2-thiazolin-4-one Formula: C16H10N4O6S MolecularWeight: 386.3388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=C3C(=O)N=C(S3)N

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C=C/3\C(=O)N=C(S3)N

InChI

InChI=1S/C16H10N4O6S/c17-16-18-15(21)14(27-16)7-9-2-1-3-11(6-9)26-13-5-4-10(19(22)23)8-12(13)20(24)25/h1-8H,(H2,17,18,21)/b14-7+