[3-[6-(3-methylsulfonyloxypropanoylamino)hexylamino]-3-oxidanylidene-propyl] methanesulfonate

Systemtic Name: [3-[6-(3-methylsulfonyloxypropanoylamino)hexylamino]-3-oxidanylidene-propyl] methanesulfonate Openeye Name: [3-[6-(3-methylsulfonyloxypropanoylamino)hexylamino]-3-oxo-propyl] methanesulfonate CAS Name: methanesulfonic acid [3-[6-[(3-methylsulfonyloxy-1-oxopropyl)amino]hexylamino]-3-oxopropyl] ester IUPAC Name: [3-[6-(3-methylsulfonyloxypropanoylamino)hexylamino]-3-oxopropyl] methanesulfonate Traditional Name: methanesulfonic acid [3-keto-3-[6-(3-methylsulfonyloxypropanoylamino)hexylamino]propyl] ester Formula: C14H28N2O8S2 MolecularWeight: 416.51072

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC(=O)NCCCCCCNC(=O)CCOS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OCCC(=O)NCCCCCCNC(=O)CCOS(=O)(=O)C

InChI

InChI=1S/C14H28N2O8S2/c1-25(19,20)23-11-7-13(17)15-9-5-3-4-6-10-16-14(18)8-12-24-26(2,21)22/h3-12H2,1-2H3,(H,15,17)(H,16,18)