ethyl-[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: ethyl-[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: ethyl-[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenyl-ethyl]-[(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: ethyl-[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: ethyl-[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: ethyl-[(1S)-2-(ethylcarbamoylamino)-2-keto-1-phenyl-ethyl]-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C21H27FN3O3+ MolecularWeight: 388.455783

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+](CC)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH+](CC)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C21H26FN3O3/c1-4-23-21(27)24-20(26)19(16-9-7-6-8-10-16)25(5-2)14-15-11-12-18(28-3)17(22)13-15/h6-13,19H,4-5,14H2,1-3H3,(H2,23,24,26,27)/p+1/t19-/m0/s1