[(1R,2S)-1-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-4-oxidanyl-butyl] N-(4-ethanoylphenyl)carbamate

Systemtic Name: [(1R,2S)-1-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-4-oxidanyl-butyl] N-(4-ethanoylphenyl)carbamate Openeye Name: [(1R,2S)-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)-2-methyl-butyl] N-(4-acetylphenyl)carbamate CAS Name: N-(4-acetylphenyl)carbamic acid [(1R,2S)-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)-2-methylbutyl] ester IUPAC Name: [(1R,2S)-4-hydroxy-1-(3-hydroxy-4-methoxyphenyl)-2-methylbutyl] N-(4-acetylphenyl)carbamate Traditional Name: N-(4-acetylphenyl)carbamic acid [(1R,2S)-4-hydroxy-1-(3-hydroxy-4-methoxy-phenyl)-2-methyl-butyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6/c1-13(10-11-23)20(16-6-9-19(27-3)18(25)12-16)28-21(26)22-17-7-4-15(5-8-17)14(2)24/h4-9,12-13,20,23,25H,10-11H2,1-3H3,(H,22,26)/t13-,20+/m0/s1