(1R)-2-(4-methyl-1,4-diazepane-1,4-diium-1-yl)-1-phenyl-ethanol

Systemtic Name: (1R)-2-(4-methyl-1,4-diazepane-1,4-diium-1-yl)-1-phenyl-ethanol Openeye Name: (1R)-2-(4-methyl-1,4-diazepane-1,4-diium-1-yl)-1-phenyl-ethanol CAS Name: (1R)-2-(4-methyl-1,4-diazepane-1,4-diium-1-yl)-1-phenylethanol IUPAC Name: (1R)-2-(4-methyl-1,4-diazepane-1,4-diium-1-yl)-1-phenylethanol Traditional Name: (1R)-2-(4-methyl-1,4-diazepane-1,4-diium-1-yl)-1-phenyl-ethanol Formula: C14H24N2O+2 MolecularWeight: 236.35316

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC[NH+](CC1)CC(C2=CC=CC=C2)O

Isomeric SMILES

C[NH+]1CCC[NH+](CC1)C[C@@H](C2=CC=CC=C2)O

InChI

InChI=1S/C14H22N2O/c1-15-8-5-9-16(11-10-15)12-14(17)13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3/p+2/t14-/m0/s1