4-tert-butyl-2,6-bis[[(phenylmethyl)amino]methyl]phenol hydrochloride

Systemtic Name: 4-tert-butyl-2,6-bis[[(phenylmethyl)amino]methyl]phenol hydrochloride Openeye Name: 2,6-bis[(benzylamino)methyl]-4-tert-butyl-phenol hydrochloride CAS Name: 4-tert-butyl-2,6-bis[[(phenylmethyl)amino]methyl]phenol hydrochloride IUPAC Name: 2,6-bis[(benzylamino)methyl]-4-tert-butylphenol hydrochloride Traditional Name: 2,6-bis[(benzylamino)methyl]-4-tert-butyl-phenol hydrochloride Formula: C26H33ClN2O MolecularWeight: 425.00602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)CNCC2=CC=CC=C2)O)CNCC3=CC=CC=C3.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)CNCC2=CC=CC=C2)O)CNCC3=CC=CC=C3.Cl

InChI

InChI=1S/C26H32N2O.ClH/c1-26(2,3)24-14-22(18-27-16-20-10-6-4-7-11-20)25(29)23(15-24)19-28-17-21-12-8-5-9-13-21;/h4-15,27-29H,16-19H2,1-3H3;1H