[(2R)-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 4-(dimethylamino)benzoate

Systemtic Name: [(2R)-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 4-(dimethylamino)benzoate Openeye Name: [(1R)-2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl] 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid [(2R)-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[4-(furan-2-carbonyl)piperazin-1-yl]-1-oxopropan-2-yl] 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid [(1R)-2-[4-(2-furoyl)piperazino]-2-keto-1-methyl-ethyl] ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)OC(=O)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)OC(=O)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C21H25N3O5/c1-15(29-21(27)16-6-8-17(9-7-16)22(2)3)19(25)23-10-12-24(13-11-23)20(26)18-5-4-14-28-18/h4-9,14-15H,10-13H2,1-3H3/t15-/m1/s1