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

Systemtic Name: 2-[(E)-2-(5-bromanyl-2-methoxy-phenyl)ethenyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[(E)-2-(5-bromo-2-methoxy-phenyl)vinyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[(E)-2-(5-bromo-2-methoxyphenyl)ethenyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(5-bromo-2-methoxyphenyl)ethenyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-(5-bromo-2-methoxy-phenyl)vinyl]-6-nitro-1,3-benzothiazole Formula: C16H11BrN2O3S MolecularWeight: 391.23914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11BrN2O3S/c1-22-14-6-3-11(17)8-10(14)2-7-16-18-13-5-4-12(19(20)21)9-15(13)23-16/h2-9H,1H3/b7-2+