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4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methyl-piperazine-1-carboxylate

4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methyl-piperazine-1-carboxylate

Systemtic Name:4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methyl-piperazine-1-carboxylate
Openeye Name:4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methyl-piperazine-1-carboxylate
CAS Name:4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methyl-1-piperazinecarboxylate
IUPAC Name:4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methylpiperazine-1-carboxylate
Traditional Name:4-[4-cyano-3-(trifluoromethyl)phenyl]-3-methyl-piperazine-1-carboxylate
Formula: C14H13F3N3O2-
MolecularWeight: 312.26713
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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)[O-]


Isomeric SMILES

CC1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)[O-]


InChI

InChI=1S/C14H14F3N3O2/c1-9-8-19(13(21)22)4-5-20(9)11-3-2-10(7-18)12(6-11)14(15,16)17/h2-3,6,9H,4-5,8H2,1H3,(H,21,22)/p-1


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