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

Systemtic Name: (3,4-dimethylphenyl) (E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoate Openeye Name: (3,4-dimethylphenyl) (E)-3-(4-morpholinosulfonylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) (E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-morpholinosulfonylphenyl)acrylic acid (3,4-dimethylphenyl) ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO5S/c1-16-3-7-19(15-17(16)2)27-21(23)10-6-18-4-8-20(9-5-18)28(24,25)22-11-13-26-14-12-22/h3-10,15H,11-14H2,1-2H3/b10-6+