[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium

Systemtic Name: [2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium Openeye Name: benzhydryl-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethyl]-(diphenylmethyl)ammonium IUPAC Name: benzhydryl-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethyl]azanium Traditional Name: benzhydryl-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-keto-ethyl]ammonium Formula: C24H23FN3O+ MolecularWeight: 388.457323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC(=O)N(CCC#N)C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC(=O)N(CCC#N)C3=CC=CC=C3F

InChI

InChI=1S/C24H22FN3O/c25-21-14-7-8-15-22(21)28(17-9-16-26)23(29)18-27-24(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-15,24,27H,9,17-18H2/p+1