2-azanyl-5-[(3-methoxy-5-nitro-2-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[(3-methoxy-5-nitro-2-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[(2-hydroxy-3-methoxy-5-nitro-phenyl)methylene]thiazol-4-one CAS Name: 2-amino-5-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-(2-hydroxy-3-methoxy-5-nitro-benzylidene)-2-thiazolin-4-one Formula: C11H9N3O5S MolecularWeight: 295.27126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)[N+](=O)[O-])C=C2C(=O)N=C(S2)N)O

Isomeric SMILES

COC1=C(C(=CC(=C1)[N+](=O)[O-])C=C2C(=O)N=C(S2)N)O

InChI

InChI=1S/C11H9N3O5S/c1-19-7-4-6(14(17)18)2-5(9(7)15)3-8-10(16)13-11(12)20-8/h2-4,15H,1H3,(H2,12,13,16)