2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)vinyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)vinyl]-6-nitro-1,3-benzothiazole Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C=CC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)/C=C/C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O5S/c1-23-14-8-11(9-15-18(14)25-7-6-24-15)2-5-17-19-13-4-3-12(20(21)22)10-16(13)26-17/h2-5,8-10H,6-7H2,1H3/b5-2+