[(1R)-1-[2,4-bis(fluoranyl)phenyl]ethyl]-[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(1R)-1-[2,4-bis(fluoranyl)phenyl]ethyl]-[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl]-[(1R)-1-(2,4-difluorophenyl)ethyl]ammonium CAS Name: [2-(4-cyanoanilino)-2-oxoethyl]-[(1R)-1-(2,4-difluorophenyl)ethyl]ammonium IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl]-[(1R)-1-(2,4-difluorophenyl)ethyl]azanium Traditional Name: [2-(4-cyanoanilino)-2-keto-ethyl]-[(1R)-1-(2,4-difluorophenyl)ethyl]ammonium Formula: C17H16F2N3O+ MolecularWeight: 316.325246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)F)F)[NH2+]CC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H](C1=C(C=C(C=C1)F)F)[NH2+]CC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H15F2N3O/c1-11(15-7-4-13(18)8-16(15)19)21-10-17(23)22-14-5-2-12(9-20)3-6-14/h2-8,11,21H,10H2,1H3,(H,22,23)/p+1/t11-/m1/s1