[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl] (2S)-2-(methylsulfonylamino)-3-phenyl-propanoate

Systemtic Name: [(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl] (2S)-2-(methylsulfonylamino)-3-phenyl-propanoate Openeye Name: [(3R)-8-methoxychroman-3-yl] (2S)-2-(methanesulfonamido)-3-phenyl-propanoate CAS Name: (2S)-2-(methanesulfonamido)-3-phenylpropanoic acid [(3R)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl] (2S)-2-(methanesulfonamido)-3-phenylpropanoate Traditional Name: (2S)-2-(methanesulfonamido)-3-phenyl-propionic acid [(3R)-8-methoxychroman-3-yl] ester Formula: C20H23NO6S MolecularWeight: 405.46472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(C2)OC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C

Isomeric SMILES

COC1=CC=CC2=C1OC[C@@H](C2)OC(=O)[C@H](CC3=CC=CC=C3)NS(=O)(=O)C

InChI

InChI=1S/C20H23NO6S/c1-25-18-10-6-9-15-12-16(13-26-19(15)18)27-20(22)17(21-28(2,23)24)11-14-7-4-3-5-8-14/h3-10,16-17,21H,11-13H2,1-2H3/t16-,17+/m1/s1