[5-[[ethylcarbamoyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[ethylcarbamoyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[ethylcarbamoyl(tetrahydrofuran-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[ethylcarbamoyl(2-oxolanylmethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[ethylcarbamoyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[ethylcarbamoyl(tetrahydrofurfuryl)amino]methyl]-2-methoxy-phenyl] ester Formula: C17H26N2O6S MolecularWeight: 386.46314

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CC1CCCO1)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C

Isomeric SMILES

CCNC(=O)N(CC1CCCO1)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C

InChI

InChI=1S/C17H26N2O6S/c1-4-18-17(20)19(12-14-6-5-9-24-14)11-13-7-8-15(23-2)16(10-13)25-26(3,21)22/h7-8,10,14H,4-6,9,11-12H2,1-3H3,(H,18,20)