(4-bromophenyl) (E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate

Systemtic Name: (4-bromophenyl) (E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate Openeye Name: (4-bromophenyl) (E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) (E)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylic acid (4-bromophenyl) ester Formula: C20H20BrNO6S MolecularWeight: 482.3449

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)Br)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC=C(C=C2)Br)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H20BrNO6S/c1-26-18-8-2-15(3-9-20(23)28-17-6-4-16(21)5-7-17)14-19(18)29(24,25)22-10-12-27-13-11-22/h2-9,14H,10-13H2,1H3/b9-3+