(2S)-3-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-2-methyl-propanal

Systemtic Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-2-methyl-propanal Openeye Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-2-methyl-propanal CAS Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-2-methylpropanal IUPAC Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-2-methylpropanal Traditional Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-2-methyl-propionaldehyde Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)OCO2)(C=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@](CC1=CC2=C(C=C1)OCO2)(C=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18O4/c1-18(11-19,14-4-6-15(20-2)7-5-14)10-13-3-8-16-17(9-13)22-12-21-16/h3-9,11H,10,12H2,1-2H3/t18-/m1/s1