4-[1,3-benzoxazol-2-yl(methyl)amino]butyl methanesulfonate

Systemtic Name: 4-[1,3-benzoxazol-2-yl(methyl)amino]butyl methanesulfonate Openeye Name: 4-[1,3-benzoxazol-2-yl(methyl)amino]butyl methanesulfonate CAS Name: methanesulfonic acid 4-[1,3-benzoxazol-2-yl(methyl)amino]butyl ester IUPAC Name: 4-[1,3-benzoxazol-2-yl(methyl)amino]butyl methanesulfonate Traditional Name: methanesulfonic acid 4-[1,3-benzoxazol-2-yl(methyl)amino]butyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCOS(=O)(=O)C)C1=NC2=CC=CC=C2O1

Isomeric SMILES

CN(CCCCOS(=O)(=O)C)C1=NC2=CC=CC=C2O1

InChI

InChI=1S/C13H18N2O4S/c1-15(9-5-6-10-18-20(2,16)17)13-14-11-7-3-4-8-12(11)19-13/h3-4,7-8H,5-6,9-10H2,1-2H3