4-[(4S,5S)-5-(hydroxymethyl)-4-methyl-4,5-dihydro-1,2-oxazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[(4S,5S)-5-(hydroxymethyl)-4-methyl-4,5-dihydro-1,2-oxazol-3-yl]benzenecarbonitrile Openeye Name: 4-[(4S,5S)-5-(hydroxymethyl)-4-methyl-4,5-dihydroisoxazol-3-yl]benzonitrile CAS Name: 4-[(4S,5S)-5-(hydroxymethyl)-4-methyl-4,5-dihydroisoxazol-3-yl]benzonitrile IUPAC Name: 4-[(4S,5S)-5-(hydroxymethyl)-4-methyl-4,5-dihydro-1,2-oxazol-3-yl]benzonitrile Traditional Name: 4-[(4S,5S)-4-methyl-5-methylol-2-isoxazolin-3-yl]benzonitrile Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(ON=C1C2=CC=C(C=C2)C#N)CO

Isomeric SMILES

C[C@@H]1[C@H](ON=C1C2=CC=C(C=C2)C#N)CO

InChI

InChI=1S/C12H12N2O2/c1-8-11(7-15)16-14-12(8)10-4-2-9(6-13)3-5-10/h2-5,8,11,15H,7H2,1H3/t8-,11-/m1/s1