4-[2-methyl-1-(4-methylsulfanylphenyl)propan-2-yl]morpholine; propanal

Systemtic Name: 4-[2-methyl-1-(4-methylsulfanylphenyl)propan-2-yl]morpholine; propanal Openeye Name: 4-[1,1-dimethyl-2-(4-methylsulfanylphenyl)ethyl]morpholine; propanal CAS Name: 4-[2-methyl-1-[4-(methylthio)phenyl]propan-2-yl]morpholine; propanal IUPAC Name: 4-[2-methyl-1-(4-methylsulfanylphenyl)propan-2-yl]morpholine; propanal Traditional Name: 4-[1,1-dimethyl-2-[4-(methylthio)phenyl]ethyl]morpholine; propionaldehyde Formula: C18H29NO2S MolecularWeight: 323.49336

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Descriptors Computed from Structure

Canonical SMILES:

CCC=O.CC(C)(CC1=CC=C(C=C1)SC)N2CCOCC2

Isomeric SMILES

CCC=O.CC(C)(CC1=CC=C(C=C1)SC)N2CCOCC2

InChI

InChI=1S/C15H23NOS.C3H6O/c1-15(2,16-8-10-17-11-9-16)12-13-4-6-14(18-3)7-5-13;1-2-3-4/h4-7H,8-12H2,1-3H3;3H,2H2,1H3