8-[6-(oxan-2-yl)hexyl-(phenylmethyl)amino]octane-1,7-diol

Systemtic Name: 8-[6-(oxan-2-yl)hexyl-(phenylmethyl)amino]octane-1,7-diol Openeye Name: 8-[benzyl(6-tetrahydropyran-2-ylhexyl)amino]octane-1,7-diol CAS Name: 8-[6-(2-oxanyl)hexyl-(phenylmethyl)amino]octane-1,7-diol IUPAC Name: 8-[benzyl-[6-(oxan-2-yl)hexyl]amino]octane-1,7-diol Traditional Name: 8-[benzyl(6-tetrahydropyran-2-ylhexyl)amino]octane-1,7-diol Formula: C26H45NO3 MolecularWeight: 419.6404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CCCCCCN(CC2=CC=CC=C2)CC(CCCCCCO)O

Isomeric SMILES

C1CCOC(C1)CCCCCCN(CC2=CC=CC=C2)CC(CCCCCCO)O

InChI

InChI=1S/C26H45NO3/c28-20-12-4-2-8-16-25(29)23-27(22-24-14-6-5-7-15-24)19-11-3-1-9-17-26-18-10-13-21-30-26/h5-7,14-15,25-26,28-29H,1-4,8-13,16-23H2