[(1S)-1-phenylethyl] 4-(benzotriazol-1-ylmethyl)benzoate

Systemtic Name: [(1S)-1-phenylethyl] 4-(benzotriazol-1-ylmethyl)benzoate Openeye Name: [(1S)-1-phenylethyl] 4-(benzotriazol-1-ylmethyl)benzoate CAS Name: 4-(1-benzotriazolylmethyl)benzoic acid [(1S)-1-phenylethyl] ester IUPAC Name: [(1S)-1-phenylethyl] 4-(benzotriazol-1-ylmethyl)benzoate Traditional Name: 4-(benzotriazol-1-ylmethyl)benzoic acid [(1S)-1-phenylethyl] ester Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H19N3O2/c1-16(18-7-3-2-4-8-18)27-22(26)19-13-11-17(12-14-19)15-25-21-10-6-5-9-20(21)23-24-25/h2-14,16H,15H2,1H3/t16-/m0/s1