[4-[[3-cyclopentylpropanoyl(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[3-cyclopentylpropanoyl(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[3-cyclopentylpropanoyl(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(3-cyclopentyl-1-oxopropyl)-(3-methoxypropyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[3-cyclopentylpropanoyl(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[3-cyclopentylpropanoyl(3-methoxypropyl)amino]methyl]phenyl] ester Formula: C20H31NO5S MolecularWeight: 397.52884

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)CCC2CCCC2

Isomeric SMILES

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)CCC2CCCC2

InChI

InChI=1S/C20H31NO5S/c1-25-15-5-14-21(20(22)13-10-17-6-3-4-7-17)16-18-8-11-19(12-9-18)26-27(2,23)24/h8-9,11-12,17H,3-7,10,13-16H2,1-2H3