5-chloranyl-7-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 5-chloranyl-7-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2,3-dihydro-1,4-benzodioxine Openeye Name: 5-chloro-7-[(E)-2-(4-nitrophenyl)sulfonylvinyl]-2,3-dihydro-1,4-benzodioxine CAS Name: 5-chloro-7-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2,3-dihydro-1,4-benzodioxin IUPAC Name: 5-chloro-7-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2,3-dihydro-1,4-benzodioxine Traditional Name: 5-chloro-7-[(E)-2-nosylvinyl]-2,3-dihydro-1,4-benzodioxin Formula: C16H12ClNO6S MolecularWeight: 381.78758

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C=CS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)/C=C/S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClNO6S/c17-14-9-11(10-15-16(14)24-7-6-23-15)5-8-25(21,22)13-3-1-12(2-4-13)18(19)20/h1-5,8-10H,6-7H2/b8-5+