[(1S)-1-cyanoethyl] 4-phenoxybenzoate

Systemtic Name: [(1S)-1-cyanoethyl] 4-phenoxybenzoate Openeye Name: [(1S)-1-cyanoethyl] 4-phenoxybenzoate CAS Name: 4-phenoxybenzoic acid [(1S)-1-cyanoethyl] ester IUPAC Name: [(1S)-1-cyanoethyl] 4-phenoxybenzoate Traditional Name: 4-phenoxybenzoic acid [(1S)-1-cyanoethyl] ester Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C#N)OC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C16H13NO3/c1-12(11-17)19-16(18)13-7-9-15(10-8-13)20-14-5-3-2-4-6-14/h2-10,12H,1H3/t12-/m0/s1