(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 1-[2,6-bis(chloranyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 1-[2,6-bis(chloranyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 1-(2,6-dichlorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,6-dichlorophenyl)sulfonyl-4-piperidinecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 1-(2,6-dichlorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,6-dichlorophenyl)sulfonylisonipecotic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C20H20Cl2N2O5S MolecularWeight: 471.3542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O5S/c21-15-7-4-8-16(22)18(15)30(27,28)24-11-9-14(10-12-24)20(26)29-17(19(23)25)13-5-2-1-3-6-13/h1-8,14,17H,9-12H2,(H2,23,25)