2,4,6-tris[(hexylamino)methyl]phenol hydrochloride

Systemtic Name: 2,4,6-tris[(hexylamino)methyl]phenol hydrochloride Openeye Name: 2,4,6-tris[(hexylamino)methyl]phenol hydrochloride CAS Name: 2,4,6-tris[(hexylamino)methyl]phenol hydrochloride IUPAC Name: 2,4,6-tris[(hexylamino)methyl]phenol hydrochloride Traditional Name: 2,4,6-tris[(hexylamino)methyl]phenol hydrochloride Formula: C27H52ClN3O MolecularWeight: 470.17428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1=CC(=C(C(=C1)CNCCCCCC)O)CNCCCCCC.Cl

Isomeric SMILES

CCCCCCNCC1=CC(=C(C(=C1)CNCCCCCC)O)CNCCCCCC.Cl

InChI

InChI=1S/C27H51N3O.ClH/c1-4-7-10-13-16-28-21-24-19-25(22-29-17-14-11-8-5-2)27(31)26(20-24)23-30-18-15-12-9-6-3;/h19-20,28-31H,4-18,21-23H2,1-3H3;1H