(3,4-dichlorophenyl)methyl (E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate

Systemtic Name: (3,4-dichlorophenyl)methyl (E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate Openeye Name: (3,4-dichlorophenyl)methyl (E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenoic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl (E)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylic acid (3,4-dichlorobenzyl) ester Formula: C21H21Cl2NO6S MolecularWeight: 486.36554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OCC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)OCC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H21Cl2NO6S/c1-28-19-6-3-15(13-20(19)31(26,27)24-8-10-29-11-9-24)4-7-21(25)30-14-16-2-5-17(22)18(23)12-16/h2-7,12-13H,8-11,14H2,1H3/b7-4+