[[1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-ylidene]amino] N-phenylcarbamate

Systemtic Name: [[1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-ylidene]amino] N-phenylcarbamate Openeye Name: [[1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-piperidylidene]amino] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [[1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinylidene]amino] ester IUPAC Name: [[1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-ylidene]amino] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [[1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-piperidylidene]amino] ester Formula: C18H17ClF3N4O2+ MolecularWeight: 413.80139

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=NOC(=O)NC2=CC=CC=C2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1=NOC(=O)NC2=CC=CC=C2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C18H16ClF3N4O2/c19-15-10-12(18(20,21)22)11-23-16(15)26-8-6-14(7-9-26)25-28-17(27)24-13-4-2-1-3-5-13/h1-5,10-11H,6-9H2,(H,24,27)/p+1