[(1S,2S)-2-ethoxy-1-(4-methoxy-3-oxidanyl-phenyl)-4-oxidanyl-butyl] N-(4-bromophenyl)carbamate

Systemtic Name: [(1S,2S)-2-ethoxy-1-(4-methoxy-3-oxidanyl-phenyl)-4-oxidanyl-butyl] N-(4-bromophenyl)carbamate Openeye Name: [(1S,2S)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)butyl] N-(4-bromophenyl)carbamate CAS Name: N-(4-bromophenyl)carbamic acid [(1S,2S)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)butyl] ester IUPAC Name: [(1S,2S)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)butyl] N-(4-bromophenyl)carbamate Traditional Name: N-(4-bromophenyl)carbamic acid [(1S,2S)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)butyl] ester Formula: C20H24BrNO6 MolecularWeight: 454.31166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCO)C(C1=CC(=C(C=C1)OC)O)OC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCO[C@@H](CCO)[C@H](C1=CC(=C(C=C1)OC)O)OC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C20H24BrNO6/c1-3-27-18(10-11-23)19(13-4-9-17(26-2)16(24)12-13)28-20(25)22-15-7-5-14(21)6-8-15/h4-9,12,18-19,23-24H,3,10-11H2,1-2H3,(H,22,25)/t18-,19-/m0/s1