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

Systemtic Name: [(1R,2R)-2-ethoxy-1-(4-methoxy-3-oxidanyl-phenyl)-4-oxidanyl-butyl] N-(phenylcarbonyl)carbamate Openeye Name: [(1R,2R)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)butyl] N-benzoylcarbamate CAS Name: N-benzoylcarbamic 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-benzoylcarbamate Traditional Name: N-benzoylcarbamic acid [(1R,2R)-2-ethoxy-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)butyl] ester Formula: C21H25NO7 MolecularWeight: 403.4257

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCO)C(C1=CC(=C(C=C1)OC)O)OC(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO7/c1-3-28-18(11-12-23)19(15-9-10-17(27-2)16(24)13-15)29-21(26)22-20(25)14-7-5-4-6-8-14/h4-10,13,18-19,23-24H,3,11-12H2,1-2H3,(H,22,25,26)/t18-,19-/m1/s1