(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C19H16ClNO5 MolecularWeight: 373.78704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC2=C(C(=C1)Cl)OCCO2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC2=C(C(=C1)Cl)OCCO2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16ClNO5/c1-12(26-15-4-2-13(10-21)3-5-15)19(22)25-11-14-8-16(20)18-17(9-14)23-6-7-24-18/h2-5,8-9,12H,6-7,11H2,1H3/t12-/m0/s1