3-[3-(hexylamino)-2-oxidanyl-propoxy]-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-olate

Systemtic Name: 3-[3-(hexylamino)-2-oxidanyl-propoxy]-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-olate Openeye Name: 3-[3-(hexylamino)-2-hydroxy-propoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-olate CAS Name: 3-[3-(hexylamino)-2-hydroxypropoxy]-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanolate IUPAC Name: 3-[3-(hexylamino)-2-hydroxypropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-olate Traditional Name: 3-[3-(hexylamino)-2-hydroxy-propoxy]-4,5-dihydroxy-6-methylol-tetrahydropyran-2-olate Formula: C15H30NO7- MolecularWeight: 336.4012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC(COC1C(C(C(OC1[O-])CO)O)O)O

Isomeric SMILES

CCCCCCNCC(COC1C(C(C(OC1[O-])CO)O)O)O

InChI

InChI=1S/C15H30NO7/c1-2-3-4-5-6-16-7-10(18)9-22-14-13(20)12(19)11(8-17)23-15(14)21/h10-20H,2-9H2,1H3/q-1