tert-butyl 4-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H28ClN3O5 MolecularWeight: 413.89572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC(=C(C=C2OC)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC(=C(C=C2OC)OC)Cl

InChI

InChI=1S/C19H28ClN3O5/c1-19(2,3)28-18(25)23-8-6-22(7-9-23)12-17(24)21-14-10-13(20)15(26-4)11-16(14)27-5/h10-11H,6-9,12H2,1-5H3,(H,21,24)