(2R)-2-(1,3-benzodioxol-4-yl)heptanoic acid

Systemtic Name: (2R)-2-(1,3-benzodioxol-4-yl)heptanoic acid Openeye Name: (2R)-2-(1,3-benzodioxol-4-yl)heptanoic acid CAS Name: (2R)-2-(1,3-benzodioxol-4-yl)heptanoic acid IUPAC Name: (2R)-2-(1,3-benzodioxol-4-yl)heptanoic acid Traditional Name: (2R)-2-(1,3-benzodioxol-4-yl)enanthic acid Formula: C14H18O4 MolecularWeight: 250.29032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C2C(=CC=C1)OCO2)C(=O)O

Isomeric SMILES

CCCCC[C@H](C1=C2C(=CC=C1)OCO2)C(=O)O

InChI

InChI=1S/C14H18O4/c1-2-3-4-6-11(14(15)16)10-7-5-8-12-13(10)18-9-17-12/h5,7-8,11H,2-4,6,9H2,1H3,(H,15,16)/t11-/m1/s1