(3S)-3-(4-methoxyphenyl)-4-methyl-pentanal

Systemtic Name: (3S)-3-(4-methoxyphenyl)-4-methyl-pentanal Openeye Name: (3S)-3-(4-methoxyphenyl)-4-methyl-pentanal CAS Name: (3S)-3-(4-methoxyphenyl)-4-methylpentanal IUPAC Name: (3S)-3-(4-methoxyphenyl)-4-methylpentanal Traditional Name: (3S)-3-(4-methoxyphenyl)-4-methyl-valeraldehyde Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)[C@H](CC=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C13H18O2/c1-10(2)13(8-9-14)11-4-6-12(15-3)7-5-11/h4-7,9-10,13H,8H2,1-3H3/t13-/m0/s1