tert-butyl 4-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(2-chloroanilino)-3-oxo-propyl]piperazine-1-carboxylate CAS Name: 4-[3-(2-chloroanilino)-3-oxopropyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(2-chloroanilino)-3-oxopropyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-chloroanilino)-3-keto-propyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C18H26ClN3O3 MolecularWeight: 367.87034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCC(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCC(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C18H26ClN3O3/c1-18(2,3)25-17(24)22-12-10-21(11-13-22)9-8-16(23)20-15-7-5-4-6-14(15)19/h4-7H,8-13H2,1-3H3,(H,20,23)