(4-cyanophenyl) (3S)-5-oxidanylidene-3-phenyl-hexanoate

Systemtic Name: (4-cyanophenyl) (3S)-5-oxidanylidene-3-phenyl-hexanoate Openeye Name: (4-cyanophenyl) (3S)-5-oxo-3-phenyl-hexanoate CAS Name: (3S)-5-oxo-3-phenylhexanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) (3S)-5-oxo-3-phenylhexanoate Traditional Name: (3S)-5-keto-3-phenyl-hexanoic acid (4-cyanophenyl) ester Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CC(=O)OC1=CC=C(C=C1)C#N)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C[C@@H](CC(=O)OC1=CC=C(C=C1)C#N)C2=CC=CC=C2

InChI

InChI=1S/C19H17NO3/c1-14(21)11-17(16-5-3-2-4-6-16)12-19(22)23-18-9-7-15(13-20)8-10-18/h2-10,17H,11-12H2,1H3/t17-/m0/s1