2-[(E)-2-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]ethenyl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]ethenyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[(E)-2-[5-(2-bromo-4-nitro-phenyl)-2-furyl]vinyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[(E)-2-[5-(2-bromo-4-nitrophenyl)-2-furanyl]ethenyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(E)-2-[5-(2-bromo-4-nitrophenyl)furan-2-yl]ethenyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-[5-(2-bromo-4-nitro-phenyl)-2-furyl]vinyl]-6-nitro-1,3-benzothiazole Formula: C19H10BrN3O5S MolecularWeight: 472.2688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)C=CC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)/C=C/C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H10BrN3O5S/c20-15-9-11(22(24)25)1-5-14(15)17-7-3-13(28-17)4-8-19-21-16-6-2-12(23(26)27)10-18(16)29-19/h1-10H/b8-4+