6-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2,4-dinitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Formula: C15H10N4O6S MolecularWeight: 374.3281

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O6S/c1-25-10-2-3-11-13(6-10)26-15(17-11)16-7-8-4-9(18(21)22)5-12(14(8)20)19(23)24/h2-7H,1H3,(H,16,17)