[(1S,2S)-1-(4-methoxy-3-oxidanyl-phenyl)-4-oxidanyl-2-phenoxy-butyl] N-(1,3-benzodioxol-5-yl)carbamate

Systemtic Name: [(1S,2S)-1-(4-methoxy-3-oxidanyl-phenyl)-4-oxidanyl-2-phenoxy-butyl] N-(1,3-benzodioxol-5-yl)carbamate Openeye Name: [(1S,2S)-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)-2-phenoxy-butyl] N-(1,3-benzodioxol-5-yl)carbamate CAS Name: N-(1,3-benzodioxol-5-yl)carbamic acid [(1S,2S)-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)-2-phenoxybutyl] ester IUPAC Name: [(1S,2S)-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)-2-phenoxybutyl] N-(1,3-benzodioxol-5-yl)carbamate Traditional Name: N-(1,3-benzodioxol-5-yl)carbamic acid [(1S,2S)-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)-2-phenoxy-butyl] ester Formula: C25H25NO8 MolecularWeight: 467.4679

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(CCO)OC2=CC=CC=C2)OC(=O)NC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]([C@H](CCO)OC2=CC=CC=C2)OC(=O)NC3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C25H25NO8/c1-30-20-9-7-16(13-19(20)28)24(22(11-12-27)33-18-5-3-2-4-6-18)34-25(29)26-17-8-10-21-23(14-17)32-15-31-21/h2-10,13-14,22,24,27-28H,11-12,15H2,1H3,(H,26,29)/t22-,24-/m0/s1