[(1R)-1-(benzotriazol-1-yl)butyl] benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2/c1-2-8-16(22-17(21)13-9-4-3-5-10-13)20-15-12-7-6-11-14(15)18-19-20/h3-7,9-12,16H,2,8H2,1H3/t16-/m1/s1