[(2S)-1-imidazol-1-yl-3-phenoxy-propan-2-yl] benzoate

Systemtic Name: [(2S)-1-imidazol-1-yl-3-phenoxy-propan-2-yl] benzoate Openeye Name: [(1S)-1-(imidazol-1-ylmethyl)-2-phenoxy-ethyl] benzoate CAS Name: benzoic acid [(2S)-1-(1-imidazolyl)-3-phenoxypropan-2-yl] ester IUPAC Name: [(2S)-1-imidazol-1-yl-3-phenoxypropan-2-yl] benzoate Traditional Name: benzoic acid [(1S)-1-(imidazol-1-ylmethyl)-2-phenoxy-ethyl] ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(CN2C=CN=C2)COC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O[C@@H](CN2C=CN=C2)COC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3/c22-19(16-7-3-1-4-8-16)24-18(13-21-12-11-20-15-21)14-23-17-9-5-2-6-10-17/h1-12,15,18H,13-14H2/t18-/m0/s1