methyl (3R,4R)-3-(1,3-benzodioxol-5-yl)-4-phenylmethoxy-pentanoate

Systemtic Name: methyl (3R,4R)-3-(1,3-benzodioxol-5-yl)-4-phenylmethoxy-pentanoate Openeye Name: methyl (3R,4R)-3-(1,3-benzodioxol-5-yl)-4-benzyloxy-pentanoate CAS Name: (3R,4R)-3-(1,3-benzodioxol-5-yl)-4-phenylmethoxypentanoic acid methyl ester IUPAC Name: methyl (3R,4R)-3-(1,3-benzodioxol-5-yl)-4-phenylmethoxypentanoate Traditional Name: (3R,4R)-3-(1,3-benzodioxol-5-yl)-4-benzoxy-valeric acid methyl ester Formula: C20H22O5 MolecularWeight: 342.38568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC(=O)OC)C1=CC2=C(C=C1)OCO2)OCC3=CC=CC=C3

Isomeric SMILES

C[C@H]([C@H](CC(=O)OC)C1=CC2=C(C=C1)OCO2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22O5/c1-14(23-12-15-6-4-3-5-7-15)17(11-20(21)22-2)16-8-9-18-19(10-16)25-13-24-18/h3-10,14,17H,11-13H2,1-2H3/t14-,17+/m1/s1