tert-butyl 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(4-chloroanilino)-oxomethyl]amino]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C18H27ClN4O3 MolecularWeight: 382.88498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27ClN4O3/c1-18(2,3)26-17(25)23-12-10-22(11-13-23)9-8-20-16(24)21-15-6-4-14(19)5-7-15/h4-7H,8-13H2,1-3H3,(H2,20,21,24)