4-bromanyl-6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C16H12BrN3O4S MolecularWeight: 422.25318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

InChI

InChI=1S/C16H12BrN3O4S/c1-2-24-11-3-4-12-14(7-11)25-16(19-12)18-8-9-5-10(17)6-13(15(9)21)20(22)23/h3-8H,2H2,1H3,(H,18,19)