6-[(1,3-benzodioxol-5-ylamino)methylidene]-4-bromanyl-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(1,3-benzodioxol-5-ylamino)methylidene]-4-bromanyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(1,3-benzodioxol-5-ylamino)methylene]-4-bromo-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(1,3-benzodioxol-5-ylamino)methylidene]-4-bromo-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(1,3-benzodioxol-5-ylamino)methylidene]-4-bromo-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(1,3-benzodioxol-5-ylamino)methylene]-4-bromo-2-nitro-cyclohexa-2,4-dien-1-one Formula: C14H9BrN2O5 MolecularWeight: 365.13566

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

InChI

InChI=1S/C14H9BrN2O5/c15-9-3-8(14(18)11(4-9)17(19)20)6-16-10-1-2-12-13(5-10)22-7-21-12/h1-6,16H,7H2