6-chloranyl-8-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-3,4-dihydro-2H-1,5-benzodioxepine

Systemtic Name: 6-chloranyl-8-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-3,4-dihydro-2H-1,5-benzodioxepine Openeye Name: 6-chloro-8-[(E)-2-(4-nitrophenyl)sulfonylvinyl]-3,4-dihydro-2H-1,5-benzodioxepine CAS Name: 6-chloro-8-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-3,4-dihydro-2H-1,5-benzodioxepin IUPAC Name: 6-chloro-8-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-3,4-dihydro-2H-1,5-benzodioxepine Traditional Name: 6-chloro-8-[(E)-2-nosylvinyl]-3,4-dihydro-2H-1,5-benzodioxepin Formula: C17H14ClNO6S MolecularWeight: 395.81416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C=CS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)/C=C/S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl)OC1

InChI

InChI=1S/C17H14ClNO6S/c18-15-10-12(11-16-17(15)25-8-1-7-24-16)6-9-26(22,23)14-4-2-13(3-5-14)19(20)21/h2-6,9-11H,1,7-8H2/b9-6+