propan-2-yl (3S)-3-(1,3-benzodioxol-5-yl)-3-oxidanyl-propanoate

Systemtic Name: propan-2-yl (3S)-3-(1,3-benzodioxol-5-yl)-3-oxidanyl-propanoate Openeye Name: isopropyl (3S)-3-(1,3-benzodioxol-5-yl)-3-hydroxy-propanoate CAS Name: (3S)-3-(1,3-benzodioxol-5-yl)-3-hydroxypropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-(1,3-benzodioxol-5-yl)-3-hydroxypropanoate Traditional Name: (3S)-3-(1,3-benzodioxol-5-yl)-3-hydroxy-propionic acid isopropyl ester Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O5/c1-8(2)18-13(15)6-10(14)9-3-4-11-12(5-9)17-7-16-11/h3-5,8,10,14H,6-7H2,1-2H3/t10-/m0/s1