[(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl] benzoate

Systemtic Name: [(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl] benzoate Openeye Name: [(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl] benzoate CAS Name: benzoic acid [(1R)-1-(1-benzotriazolyl)-2-methylpropyl] ester IUPAC Name: [(1R)-1-(benzotriazol-1-yl)-2-methylpropyl] benzoate Traditional Name: benzoic acid [(1R)-1-(benzotriazol-1-yl)-2-methyl-propyl] ester Formula: C17H17N3O2 MolecularWeight: 295.33578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(N1C2=CC=CC=C2N=N1)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@H](N1C2=CC=CC=C2N=N1)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2/c1-12(2)16(22-17(21)13-8-4-3-5-9-13)20-15-11-7-6-10-14(15)18-19-20/h3-12,16H,1-2H3/t16-/m1/s1