[(2S,3R)-2-(4-methoxyphenyl)-7-oxidanyl-3,4-dihydro-2H-chromen-3-yl] ethanoate

Systemtic Name: [(2S,3R)-2-(4-methoxyphenyl)-7-oxidanyl-3,4-dihydro-2H-chromen-3-yl] ethanoate Openeye Name: [(2S,3R)-7-hydroxy-2-(4-methoxyphenyl)chroman-3-yl] acetate CAS Name: acetic acid [(2S,3R)-7-hydroxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2S,3R)-7-hydroxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] acetate Traditional Name: acetic acid [(2S,3R)-7-hydroxy-2-(4-methoxyphenyl)chroman-3-yl] ester Formula: C18H18O5 MolecularWeight: 314.33252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2=C(C=C(C=C2)O)OC1C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)O[C@@H]1CC2=C(C=C(C=C2)O)O[C@H]1C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18O5/c1-11(19)22-17-9-13-3-6-14(20)10-16(13)23-18(17)12-4-7-15(21-2)8-5-12/h3-8,10,17-18,20H,9H2,1-2H3/t17-,18+/m1/s1