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

Systemtic Name: [(1R,2R)-2-ethoxy-1-(4-methoxy-3-oxidanyl-phenyl)-4-oxidanyl-butyl] N-(4-cyanophenyl)carbamate Openeye Name: [(1R,2R)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)butyl] N-(4-cyanophenyl)carbamate CAS Name: N-(4-cyanophenyl)carbamic acid [(1R,2R)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)butyl] ester IUPAC Name: [(1R,2R)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)butyl] N-(4-cyanophenyl)carbamate Traditional Name: N-(4-cyanophenyl)carbamic acid [(1R,2R)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)butyl] ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O6/c1-3-28-19(10-11-24)20(15-6-9-18(27-2)17(25)12-15)29-21(26)23-16-7-4-14(13-22)5-8-16/h4-9,12,19-20,24-25H,3,10-11H2,1-2H3,(H,23,26)/t19-,20-/m1/s1