(3R)-3-[(4S)-4-(2-methylpropyl)-5-oxidanylidene-2-phenyl-1,3-oxazol-4-yl]pentanal

Systemtic Name: (3R)-3-[(4S)-4-(2-methylpropyl)-5-oxidanylidene-2-phenyl-1,3-oxazol-4-yl]pentanal Openeye Name: (3R)-3-[(4S)-4-isobutyl-5-oxo-2-phenyl-oxazol-4-yl]pentanal CAS Name: (3R)-3-[(4S)-4-(2-methylpropyl)-5-oxo-2-phenyl-4-oxazolyl]pentanal IUPAC Name: (3R)-3-[(4S)-4-(2-methylpropyl)-5-oxo-2-phenyl-1,3-oxazol-4-yl]pentanal Traditional Name: (3R)-3-[(4S)-4-isobutyl-5-keto-2-phenyl-2-oxazolin-4-yl]valeraldehyde Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC=O)C1(C(=O)OC(=N1)C2=CC=CC=C2)CC(C)C

Isomeric SMILES

CC[C@H](CC=O)[C@]1(C(=O)OC(=N1)C2=CC=CC=C2)CC(C)C

InChI

InChI=1S/C18H23NO3/c1-4-15(10-11-20)18(12-13(2)3)17(21)22-16(19-18)14-8-6-5-7-9-14/h5-9,11,13,15H,4,10,12H2,1-3H3/t15-,18+/m1/s1