3-[(5S)-5-[(4-tert-butylphenoxy)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]benzenecarbonitrile

Systemtic Name: 3-[(5S)-5-[(4-tert-butylphenoxy)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]benzenecarbonitrile Openeye Name: 3-[(5S)-5-[(4-tert-butylphenoxy)methyl]-2-oxo-oxazolidin-3-yl]benzonitrile CAS Name: 3-[(5S)-5-[(4-tert-butylphenoxy)methyl]-2-oxo-3-oxazolidinyl]benzonitrile IUPAC Name: 3-[(5S)-5-[(4-tert-butylphenoxy)methyl]-2-oxo-1,3-oxazolidin-3-yl]benzonitrile Traditional Name: 3-[(5S)-5-[(4-tert-butylphenoxy)methyl]-2-keto-oxazolidin-3-yl]benzonitrile Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2CN(C(=O)O2)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC[C@@H]2CN(C(=O)O2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H22N2O3/c1-21(2,3)16-7-9-18(10-8-16)25-14-19-13-23(20(24)26-19)17-6-4-5-15(11-17)12-22/h4-11,19H,13-14H2,1-3H3/t19-/m0/s1