[3-[5-(3-methylsulfonyloxypropanoylamino)pentylamino]-3-oxidanylidene-propyl] methanesulfonate

Systemtic Name: [3-[5-(3-methylsulfonyloxypropanoylamino)pentylamino]-3-oxidanylidene-propyl] methanesulfonate Openeye Name: [3-[5-(3-methylsulfonyloxypropanoylamino)pentylamino]-3-oxo-propyl] methanesulfonate CAS Name: methanesulfonic acid [3-[5-[(3-methylsulfonyloxy-1-oxopropyl)amino]pentylamino]-3-oxopropyl] ester IUPAC Name: [3-[5-(3-methylsulfonyloxypropanoylamino)pentylamino]-3-oxopropyl] methanesulfonate Traditional Name: methanesulfonic acid [3-keto-3-[5-(3-methylsulfonyloxypropanoylamino)pentylamino]propyl] ester Formula: C13H26N2O8S2 MolecularWeight: 402.48414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26N2O8S2/c1-24(18,19)22-10-6-12(16)14-8-4-3-5-9-15-13(17)7-11-23-25(2,20)21/h3-11H2,1-2H3,(H,14,16)(H,15,17)