[4-[[2-methoxyethyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[2-methoxyethyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[2-methoxyethyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[2-methoxyethyl-[(E)-1-oxo-3-phenylprop-2-enyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[2-methoxyethyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[2-methoxyethyl-[(E)-3-phenylacryloyl]amino]methyl]phenyl] ester Formula: C20H23NO5S MolecularWeight: 389.46532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H23NO5S/c1-25-15-14-21(20(22)13-10-17-6-4-3-5-7-17)16-18-8-11-19(12-9-18)26-27(2,23)24/h3-13H,14-16H2,1-2H3/b13-10+