methyl (11Z)-11-(3-methylsulfonyloxypropylidene)-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl (11Z)-11-(3-methylsulfonyloxypropylidene)-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl (11Z)-11-(3-methylsulfonyloxypropylidene)-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11Z)-11-(3-methylsulfonyloxypropylidene)-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl (11Z)-11-(3-methylsulfonyloxypropylidene)-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11Z)-11-(3-methylsulfonyloxypropylidene)-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C20H20O6S MolecularWeight: 388.4342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=CCCOS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC\2=C(C=C1)OCC3=CC=CC=C3/C2=C/CCOS(=O)(=O)C

InChI

InChI=1S/C20H20O6S/c1-24-20(21)14-9-10-19-18(12-14)17(8-5-11-26-27(2,22)23)16-7-4-3-6-15(16)13-25-19/h3-4,6-10,12H,5,11,13H2,1-2H3/b17-8-