tert-butyl 4-[3-(2-chlorophenyl)phenyl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(2-chlorophenyl)phenyl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(2-chlorophenyl)phenyl]-3-oxo-piperazine-1-carboxylate CAS Name: 4-[3-(2-chlorophenyl)phenyl]-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(2-chlorophenyl)phenyl]-3-oxopiperazine-1-carboxylate Traditional Name: 4-[3-(2-chlorophenyl)phenyl]-3-keto-piperazine-1-carboxylic acid tert-butyl ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1)C2=CC=CC(=C2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1)C2=CC=CC(=C2)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H23ClN2O3/c1-21(2,3)27-20(26)23-11-12-24(19(25)14-23)16-8-6-7-15(13-16)17-9-4-5-10-18(17)22/h4-10,13H,11-12,14H2,1-3H3