[(E)-1-[3-pyrrolidin-1-yl-5-(trifluoromethyl)pyridin-2-yl]ethylideneamino] 4-chloranylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=CC=C(C=C1)Cl)C2=C(C=C(C=N2)C(F)(F)F)N3CCCC3

Isomeric SMILES

C/C(=N\OC(=O)C1=CC=C(C=C1)Cl)/C2=C(C=C(C=N2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C19H17ClF3N3O2/c1-12(25-28-18(27)13-4-6-15(20)7-5-13)17-16(26-8-2-3-9-26)10-14(11-24-17)19(21,22)23/h4-7,10-11H,2-3,8-9H2,1H3/b25-12+