(2,5,5-trimethyl-2-phenyl-4H-1,3-benzodioxepin-7-yl) methanesulfonate

Systemtic Name: (2,5,5-trimethyl-2-phenyl-4H-1,3-benzodioxepin-7-yl) methanesulfonate Openeye Name: (2,5,5-trimethyl-2-phenyl-4H-1,3-benzodioxepin-7-yl) methanesulfonate CAS Name: methanesulfonic acid (2,5,5-trimethyl-2-phenyl-4H-1,3-benzodioxepin-7-yl) ester IUPAC Name: (2,5,5-trimethyl-2-phenyl-4H-1,3-benzodioxepin-7-yl) methanesulfonate Traditional Name: methanesulfonic acid (2,5,5-trimethyl-2-phenyl-4H-1,3-benzodioxepin-7-yl) ester Formula: C19H22O5S MolecularWeight: 362.43998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC2=C1C=C(C=C2)OS(=O)(=O)C)(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1(COC(OC2=C1C=C(C=C2)OS(=O)(=O)C)(C)C3=CC=CC=C3)C

InChI

InChI=1S/C19H22O5S/c1-18(2)13-22-19(3,14-8-6-5-7-9-14)23-17-11-10-15(12-16(17)18)24-25(4,20)21/h5-12H,13H2,1-4H3