tert-butyl 4-[(3-chloranyl-2-methyl-phenyl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-chloranyl-2-methyl-phenyl)carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(3-chloro-2-methyl-phenyl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[(3-chloro-2-methylanilino)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-chloro-2-methylphenyl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(3-chloro-2-methyl-phenyl)carbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H24ClN3O3/c1-12-13(18)6-5-7-14(12)19-15(22)20-8-10-21(11-9-20)16(23)24-17(2,3)4/h5-7H,8-11H2,1-4H3,(H,19,22)