[4-[[butan-2-yl(naphthalen-1-ylsulfonyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[butan-2-yl(naphthalen-1-ylsulfonyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[1-naphthylsulfonyl(sec-butyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butan-2-yl(1-naphthalenylsulfonyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[butan-2-yl(naphthalen-1-ylsulfonyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[1-naphthylsulfonyl(sec-butyl)amino]methyl]phenyl] ester Formula: C22H25NO5S2 MolecularWeight: 447.5676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H25NO5S2/c1-4-17(2)23(16-18-12-14-20(15-13-18)28-29(3,24)25)30(26,27)22-11-7-9-19-8-5-6-10-21(19)22/h5-15,17H,4,16H2,1-3H3