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

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)propanal Openeye Name: (2S)-2-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)propanal CAS Name: (2S)-2-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)propanal IUPAC Name: (2S)-2-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)propanal Traditional Name: (2S)-2-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)propionaldehyde Formula: C16H13ClO3 MolecularWeight: 288.72562

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC3=CC=C(C=C3)Cl)C=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@H](CC3=CC=C(C=C3)Cl)C=O

InChI

InChI=1S/C16H13ClO3/c17-14-4-1-11(2-5-14)7-13(9-18)12-3-6-15-16(8-12)20-10-19-15/h1-6,8-9,13H,7,10H2/t13-/m1/s1