tert-butyl N-[2-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]ethyl]carbamate Openeye Name: tert-butyl N-[2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]ethyl]carbamate CAS Name: N-[2-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]ethyl]carbamate Traditional Name: N-[2-[4-(3,4-dichlorobenzoyl)piperazino]ethyl]carbamic acid tert-butyl ester Formula: C18H25Cl2N3O3 MolecularWeight: 402.3154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H25Cl2N3O3/c1-18(2,3)26-17(25)21-6-7-22-8-10-23(11-9-22)16(24)13-4-5-14(19)15(20)12-13/h4-5,12H,6-11H2,1-3H3,(H,21,25)