[4-[[2-methoxyethyl(naphthalen-2-ylsulfonyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[2-methoxyethyl(naphthalen-2-ylsulfonyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[2-methoxyethyl(2-naphthylsulfonyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[2-methoxyethyl(2-naphthalenylsulfonyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[2-methoxyethyl(naphthalen-2-ylsulfonyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[2-methoxyethyl(2-naphthylsulfonyl)amino]methyl]phenyl] ester Formula: C21H23NO6S2 MolecularWeight: 449.54042

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H23NO6S2/c1-27-14-13-22(16-17-7-10-20(11-8-17)28-29(2,23)24)30(25,26)21-12-9-18-5-3-4-6-19(18)15-21/h3-12,15H,13-14,16H2,1-2H3