[4-(morpholin-4-ylmethyl)phenyl] 2-cyano-3-ethenyl-4-methyl-benzenesulfonate

Systemtic Name: [4-(morpholin-4-ylmethyl)phenyl] 2-cyano-3-ethenyl-4-methyl-benzenesulfonate Openeye Name: [4-(morpholinomethyl)phenyl] 2-cyano-4-methyl-3-vinyl-benzenesulfonate CAS Name: 2-cyano-3-ethenyl-4-methylbenzenesulfonic acid [4-(4-morpholinylmethyl)phenyl] ester IUPAC Name: [4-(morpholin-4-ylmethyl)phenyl] 2-cyano-3-ethenyl-4-methylbenzenesulfonate Traditional Name: 2-cyano-4-methyl-3-vinyl-benzenesulfonic acid [4-(morpholinomethyl)phenyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CN3CCOCC3)C#N)C=C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CN3CCOCC3)C#N)C=C

InChI

InChI=1S/C21H22N2O4S/c1-3-19-16(2)4-9-21(20(19)14-22)28(24,25)27-18-7-5-17(6-8-18)15-23-10-12-26-13-11-23/h3-9H,1,10-13,15H2,2H3