[(2S)-3,3,5-trimethyl-6-oxidanylidene-2-phenyl-2H-pyran-4-yl] benzoate

Systemtic Name: [(2S)-3,3,5-trimethyl-6-oxidanylidene-2-phenyl-2H-pyran-4-yl] benzoate Openeye Name: [(2S)-3,3,5-trimethyl-6-oxo-2-phenyl-2H-pyran-4-yl] benzoate CAS Name: benzoic acid [(2S)-3,3,5-trimethyl-6-oxo-2-phenyl-2H-pyran-4-yl] ester IUPAC Name: [(2S)-3,3,5-trimethyl-6-oxo-2-phenyl-2H-pyran-4-yl] benzoate Traditional Name: benzoic acid [(2S)-6-keto-3,3,5-trimethyl-2-phenyl-2H-pyran-4-yl] ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(OC1=O)C2=CC=CC=C2)(C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C([C@@H](OC1=O)C2=CC=CC=C2)(C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20O4/c1-14-17(24-20(23)16-12-8-5-9-13-16)21(2,3)18(25-19(14)22)15-10-6-4-7-11-15/h4-13,18H,1-3H3/t18-/m0/s1