1-[[2-chloranyl-5-(trifluoromethyl)phenyl]-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[[2-chloranyl-5-(trifluoromethyl)phenyl]-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]piperazine Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]piperazine CAS Name: 1-[[2-chloro-5-(trifluoromethyl)phenyl]-(3-ethoxy-4-phenylmethoxyphenyl)methyl]piperazine IUPAC Name: 1-[[2-chloro-5-(trifluoromethyl)phenyl]-(3-ethoxy-4-phenylmethoxyphenyl)methyl]piperazine Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]piperazine Formula: C27H28ClF3N2O2 MolecularWeight: 504.97163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=C(C=CC(=C2)C(F)(F)F)Cl)N3CCNCC3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=C(C=CC(=C2)C(F)(F)F)Cl)N3CCNCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H28ClF3N2O2/c1-2-34-25-16-20(8-11-24(25)35-18-19-6-4-3-5-7-19)26(33-14-12-32-13-15-33)22-17-21(27(29,30)31)9-10-23(22)28/h3-11,16-17,26,32H,2,12-15,18H2,1H3