ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]azanium

Systemtic Name: ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]azanium Openeye Name: ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]-[2-(4-isopropylanilino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[(3-fluoro-4-methoxyphenyl)methyl]-[2-oxo-2-(4-propan-2-ylanilino)ethyl]ammonium IUPAC Name: ethyl-[(3-fluoro-4-methoxyphenyl)methyl]-[2-oxo-2-(4-propan-2-ylanilino)ethyl]azanium Traditional Name: (2-cumidino-2-keto-ethyl)-ethyl-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C21H28FN2O2+ MolecularWeight: 359.457623

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H27FN2O2/c1-5-24(13-16-6-11-20(26-4)19(22)12-16)14-21(25)23-18-9-7-17(8-10-18)15(2)3/h6-12,15H,5,13-14H2,1-4H3,(H,23,25)/p+1