[(1R)-2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] furan-2-carboxylate

Systemtic Name: [(1R)-2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] furan-2-carboxylate Openeye Name: [(1R)-2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxo-ethyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [(1R)-2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [(1R)-2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [(1R)-2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)NC2CCCCC2)OC(=O)C3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](C(=O)NC2CCCCC2)OC(=O)C3=CC=CO3)OC

InChI

InChI=1S/C21H25NO6/c1-25-16-11-10-14(13-18(16)26-2)19(28-21(24)17-9-6-12-27-17)20(23)22-15-7-4-3-5-8-15/h6,9-13,15,19H,3-5,7-8H2,1-2H3,(H,22,23)/t19-/m1/s1