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

Systemtic Name: 2-[(E)-2-(3-bromanyl-4-methoxy-phenyl)ethenyl]-5-nitro-1,3-benzothiazole Openeye Name: 2-[(E)-2-(3-bromo-4-methoxy-phenyl)vinyl]-5-nitro-1,3-benzothiazole CAS Name: 2-[(E)-2-(3-bromo-4-methoxyphenyl)ethenyl]-5-nitro-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(3-bromo-4-methoxyphenyl)ethenyl]-5-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-(3-bromo-4-methoxy-phenyl)vinyl]-5-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)C=CC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-])Br

Isomeric SMILES

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

InChI

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