4-(2-hydroxyethyl)-4-methyl-1,4-oxazepan-4-ium-6-ol

Systemtic Name: 4-(2-hydroxyethyl)-4-methyl-1,4-oxazepan-4-ium-6-ol Openeye Name: 4-(2-hydroxyethyl)-4-methyl-1,4-oxazepan-4-ium-6-ol CAS Name: 4-(2-hydroxyethyl)-4-methyl-1,4-oxazepan-4-ium-6-ol IUPAC Name: 4-(2-hydroxyethyl)-4-methyl-1,4-oxazepan-4-ium-6-ol Traditional Name: 4-(2-hydroxyethyl)-4-methyl-1,4-oxazepan-4-ium-6-ol Formula: C8H18NO3+ MolecularWeight: 176.23342

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC(C1)O)CCO

Isomeric SMILES

C[N+]1(CCOCC(C1)O)CCO

InChI

InChI=1S/C8H18NO3/c1-9(2-4-10)3-5-12-7-8(11)6-9/h8,10-11H,2-7H2,1H3/q+1