tert-butyl 4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(3-chloro-4-methoxy-phenyl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[(3-chloro-4-methoxyanilino)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-chloro-4-methoxyphenyl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(3-chloro-4-methoxy-phenyl)carbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H24ClN3O4 MolecularWeight: 369.84316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NC2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NC2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C17H24ClN3O4/c1-17(2,3)25-16(23)21-9-7-20(8-10-21)15(22)19-12-5-6-14(24-4)13(18)11-12/h5-6,11H,7-10H2,1-4H3,(H,19,22)