2-azanyl-1-cyclohexyl-heptane-3,4-diol

Systemtic Name: 2-azanyl-1-cyclohexyl-heptane-3,4-diol Openeye Name: 2-amino-1-cyclohexyl-heptane-3,4-diol CAS Name: 2-amino-1-cyclohexylheptane-3,4-diol IUPAC Name: 2-amino-1-cyclohexylheptane-3,4-diol Traditional Name: 2-amino-1-cyclohexyl-heptane-3,4-diol Formula: C13H27NO2 MolecularWeight: 229.35898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C(CC1CCCCC1)N)O)O

Isomeric SMILES

CCCC(C(C(CC1CCCCC1)N)O)O

InChI

InChI=1S/C13H27NO2/c1-2-6-12(15)13(16)11(14)9-10-7-4-3-5-8-10/h10-13,15-16H,2-9,14H2,1H3