(1S,2R)-2-(benzotriazol-1-yl)-2-methyl-1-(4-methylphenyl)octan-1-ol

Systemtic Name: (1S,2R)-2-(benzotriazol-1-yl)-2-methyl-1-(4-methylphenyl)octan-1-ol Openeye Name: (1S,2R)-2-(benzotriazol-1-yl)-2-methyl-1-(p-tolyl)octan-1-ol CAS Name: (1S,2R)-2-(1-benzotriazolyl)-2-methyl-1-(4-methylphenyl)-1-octanol IUPAC Name: (1S,2R)-2-(benzotriazol-1-yl)-2-methyl-1-(4-methylphenyl)octan-1-ol Traditional Name: (1S,2R)-2-(benzotriazol-1-yl)-2-methyl-1-(p-tolyl)octan-1-ol Formula: C22H29N3O MolecularWeight: 351.48516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C(C1=CC=C(C=C1)C)O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCCC[C@](C)([C@H](C1=CC=C(C=C1)C)O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C22H29N3O/c1-4-5-6-9-16-22(3,21(26)18-14-12-17(2)13-15-18)25-20-11-8-7-10-19(20)23-24-25/h7-8,10-15,21,26H,4-6,9,16H2,1-3H3/t21-,22+/m0/s1