[4-[[hexanoyl-[[(2R)-oxolan-2-yl]methyl]amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[hexanoyl-[[(2R)-oxolan-2-yl]methyl]amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[hexanoyl-[[(2R)-tetrahydrofuran-2-yl]methyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[1-oxohexyl-[[(2R)-2-oxolanyl]methyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[hexanoyl-[[(2R)-oxolan-2-yl]methyl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[caproyl-[[(2R)-tetrahydrofuran-2-yl]methyl]amino]methyl]phenyl] ester Formula: C19H29NO5S MolecularWeight: 383.50226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(CC1CCCO1)CC2=CC=C(C=C2)OS(=O)(=O)C

Isomeric SMILES

CCCCCC(=O)N(C[C@H]1CCCO1)CC2=CC=C(C=C2)OS(=O)(=O)C

InChI

InChI=1S/C19H29NO5S/c1-3-4-5-8-19(21)20(15-18-7-6-13-24-18)14-16-9-11-17(12-10-16)25-26(2,22)23/h9-12,18H,3-8,13-15H2,1-2H3/t18-/m1/s1