(3,5-dimethylphenyl)methyl (E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoate

Systemtic Name: (3,5-dimethylphenyl)methyl (E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoate Openeye Name: (3,5-dimethylphenyl)methyl (E)-3-(4-morpholinosulfonylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenoic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl (E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-morpholinosulfonylphenyl)acrylic acid (3,5-dimethylbenzyl) ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)COC(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C22H25NO5S/c1-17-13-18(2)15-20(14-17)16-28-22(24)8-5-19-3-6-21(7-4-19)29(25,26)23-9-11-27-12-10-23/h3-8,13-15H,9-12,16H2,1-2H3/b8-5+