[(1S)-1-(benzotriazol-1-yl)propyl] benzoate

Systemtic Name: [(1S)-1-(benzotriazol-1-yl)propyl] benzoate Openeye Name: [(1S)-1-(benzotriazol-1-yl)propyl] benzoate CAS Name: benzoic acid [(1S)-1-(1-benzotriazolyl)propyl] ester IUPAC Name: [(1S)-1-(benzotriazol-1-yl)propyl] benzoate Traditional Name: benzoic acid [(1S)-1-(benzotriazol-1-yl)propyl] ester Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O2/c1-2-15(21-16(20)12-8-4-3-5-9-12)19-14-11-7-6-10-13(14)17-18-19/h3-11,15H,2H2,1H3/t15-/m0/s1