2-[(E)-2-(4-ethyl-3-nitro-phenyl)ethenyl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(4-ethyl-3-nitro-phenyl)ethenyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[(E)-2-(4-ethyl-3-nitro-phenyl)vinyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[(E)-2-(4-ethyl-3-nitrophenyl)ethenyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(4-ethyl-3-nitrophenyl)ethenyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-(4-ethyl-3-nitro-phenyl)vinyl]-6-nitro-1,3-benzothiazole Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=CC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C/C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4S/c1-2-12-5-3-11(9-15(12)20(23)24)4-8-17-18-14-7-6-13(19(21)22)10-16(14)25-17/h3-10H,2H2,1H3/b8-4+