ethyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate hydrochloride

Systemtic Name: ethyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C23H29ClF2N2O2 MolecularWeight: 438.938366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C23H28F2N2O2.ClH/c1-2-29-23(28)27-16-14-26(15-17-27)13-3-4-22(18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19;/h5-12,22H,2-4,13-17H2,1H3;1H