(3-morpholin-4-ylsulfonylphenyl)methyl (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: (3-morpholinosulfonylphenyl)methyl (E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-propenoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl (E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)acrylic acid (3-morpholinosulfonylbenzyl) ester Formula: C22H24ClNO7S MolecularWeight: 481.94646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClNO7S/c1-28-20-14-16(13-19(23)22(20)29-2)6-7-21(25)31-15-17-4-3-5-18(12-17)32(26,27)24-8-10-30-11-9-24/h3-7,12-14H,8-11,15H2,1-2H3/b7-6+