[3-[(2-azanyl-4-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]-cyclohexyl-methyl-azanium

Systemtic Name: [3-[(2-azanyl-4-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]-cyclohexyl-methyl-azanium Openeye Name: [3-(2-amino-4-fluoro-anilino)-3-oxo-propyl]-cyclohexyl-methyl-ammonium CAS Name: [3-(2-amino-4-fluoroanilino)-3-oxopropyl]-cyclohexyl-methylammonium IUPAC Name: [3-(2-amino-4-fluoroanilino)-3-oxopropyl]-cyclohexyl-methylazanium Traditional Name: [3-(2-amino-4-fluoro-anilino)-3-keto-propyl]-cyclohexyl-methyl-ammonium Formula: C16H25FN3O+ MolecularWeight: 294.387603

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC1=C(C=C(C=C1)F)N)C2CCCCC2

Isomeric SMILES

C[NH+](CCC(=O)NC1=C(C=C(C=C1)F)N)C2CCCCC2

InChI

InChI=1S/C16H24FN3O/c1-20(13-5-3-2-4-6-13)10-9-16(21)19-15-8-7-12(17)11-14(15)18/h7-8,11,13H,2-6,9-10,18H2,1H3,(H,19,21)/p+1