6-(6-azanylhexan-2-ylamino)-2-(hydroxymethyl)hexane-1,3,5-triol

Systemtic Name: 6-(6-azanylhexan-2-ylamino)-2-(hydroxymethyl)hexane-1,3,5-triol Openeye Name: 6-[(5-amino-1-methyl-pentyl)amino]-2-(hydroxymethyl)hexane-1,3,5-triol CAS Name: 6-(6-aminohexan-2-ylamino)-2-(hydroxymethyl)hexane-1,3,5-triol IUPAC Name: 6-(6-aminohexan-2-ylamino)-2-(hydroxymethyl)hexane-1,3,5-triol Traditional Name: 6-[(5-amino-1-methyl-pentyl)amino]-2-methylol-hexane-1,3,5-triol Formula: C13H30N2O4 MolecularWeight: 278.3883

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN)NCC(CC(C(CO)CO)O)O

Isomeric SMILES

CC(CCCCN)NCC(CC(C(CO)CO)O)O

InChI

InChI=1S/C13H30N2O4/c1-10(4-2-3-5-14)15-7-12(18)6-13(19)11(8-16)9-17/h10-13,15-19H,2-9,14H2,1H3