[5-[[(2-chloranyl-2-phenyl-ethanoyl)-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[(2-chloranyl-2-phenyl-ethanoyl)-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[(2-chloro-2-phenyl-acetyl)-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[(2-chloro-1-oxo-2-phenylethyl)-(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[(2-chloro-2-phenylacetyl)-(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[(2-chloro-2-phenyl-acetyl)-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C20H24ClNO6S MolecularWeight: 441.92566

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C(C2=CC=CC=C2)Cl

Isomeric SMILES

COCCN(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C(C2=CC=CC=C2)Cl

InChI

InChI=1S/C20H24ClNO6S/c1-26-12-11-22(20(23)19(21)16-7-5-4-6-8-16)14-15-9-10-17(27-2)18(13-15)28-29(3,24)25/h4-10,13,19H,11-12,14H2,1-3H3