[(2R)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2,4-bis(chloranyl)benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2,4-bis(chloranyl)benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [(2R)-1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [(1R)-2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C20H20Cl2N2O3 MolecularWeight: 407.2904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H20Cl2N2O3/c1-14(27-20(26)17-8-7-15(21)13-18(17)22)19(25)24-11-9-23(10-12-24)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3/t14-/m1/s1