[2-azanylidene-2-[3-pyrrolidin-1-yl-5-(trifluoromethyl)pyridin-2-yl]ethyl] 4-chloranylbenzoate

Systemtic Name: [2-azanylidene-2-[3-pyrrolidin-1-yl-5-(trifluoromethyl)pyridin-2-yl]ethyl] 4-chloranylbenzoate Openeye Name: [2-imino-2-[3-pyrrolidin-1-yl-5-(trifluoromethyl)-2-pyridyl]ethyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-imino-2-[3-(1-pyrrolidinyl)-5-(trifluoromethyl)-2-pyridinyl]ethyl] ester IUPAC Name: [2-imino-2-[3-pyrrolidin-1-yl-5-(trifluoromethyl)pyridin-2-yl]ethyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-imino-2-[3-pyrrolidino-5-(trifluoromethyl)-2-pyridyl]ethyl] ester Formula: C19H17ClF3N3O2 MolecularWeight: 411.80539

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(N=CC(=C2)C(F)(F)F)C(=N)COC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C2=C(N=CC(=C2)C(F)(F)F)C(=N)COC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClF3N3O2/c20-14-5-3-12(4-6-14)18(27)28-11-15(24)17-16(26-7-1-2-8-26)9-13(10-25-17)19(21,22)23/h3-6,9-10,24H,1-2,7-8,11H2