tert-butyl 4-[2-aminocarbonyl-6-chloranyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)sulfonylamino]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-aminocarbonyl-6-chloranyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)sulfonylamino]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-carbamoyl-6-chloro-4-[(2-ethoxy-2-oxo-ethyl)sulfonylamino]phenoxy]piperidine-1-carboxylate CAS Name: 4-[2-carbamoyl-6-chloro-4-[(2-ethoxy-2-oxoethyl)sulfonylamino]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-carbamoyl-6-chloro-4-[(2-ethoxy-2-oxoethyl)sulfonylamino]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[2-carbamoyl-6-chloro-4-[(2-ethoxy-2-keto-ethyl)sulfonylamino]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H30ClN3O8S MolecularWeight: 519.9962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)NC1=CC(=C(C(=C1)C(=O)N)OC2CCN(CC2)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)CS(=O)(=O)NC1=CC(=C(C(=C1)C(=O)N)OC2CCN(CC2)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C21H30ClN3O8S/c1-5-31-17(26)12-34(29,30)24-13-10-15(19(23)27)18(16(22)11-13)32-14-6-8-25(9-7-14)20(28)33-21(2,3)4/h10-11,14,24H,5-9,12H2,1-4H3,(H2,23,27)