[4-[[naphthalen-1-ylcarbamoyl(oxolan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[naphthalen-1-ylcarbamoyl(oxolan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[1-naphthylcarbamoyl(tetrahydrofuran-2-ylmethyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[(1-naphthalenylamino)-oxomethyl]-(2-oxolanylmethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[naphthalen-1-ylcarbamoyl(oxolan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[1-naphthylcarbamoyl(tetrahydrofurfuryl)amino]methyl]phenyl] ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)CN(CC2CCCO2)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)CN(CC2CCCO2)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H26N2O5S/c1-32(28,29)31-20-13-11-18(12-14-20)16-26(17-21-8-5-15-30-21)24(27)25-23-10-4-7-19-6-2-3-9-22(19)23/h2-4,6-7,9-14,21H,5,8,15-17H2,1H3,(H,25,27)