(2S,3R)-2-methyl-3-[(E)-2-phenylethenyl]hexanal

Systemtic Name: (2S,3R)-2-methyl-3-[(E)-2-phenylethenyl]hexanal Openeye Name: (2S,3R)-2-methyl-3-[(E)-styryl]hexanal CAS Name: (2S,3R)-2-methyl-3-[(E)-2-phenylethenyl]hexanal IUPAC Name: (2S,3R)-2-methyl-3-[(E)-2-phenylethenyl]hexanal Traditional Name: (E,2S,3R)-2-methyl-5-phenyl-3-propyl-pent-4-enal Formula: C15H20O MolecularWeight: 216.3187

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=CC1=CC=CC=C1)C(C)C=O

Isomeric SMILES

CCC[C@H](/C=C/C1=CC=CC=C1)[C@H](C)C=O

InChI

InChI=1S/C15H20O/c1-3-7-15(13(2)12-16)11-10-14-8-5-4-6-9-14/h4-6,8-13,15H,3,7H2,1-2H3/b11-10+/t13-,15-/m1/s1