ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]-[2-(isobutylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[(3-fluoro-4-methoxyphenyl)methyl]-[2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl]ammonium IUPAC Name: ethyl-[(3-fluoro-4-methoxyphenyl)methyl]-[2-(2-methylpropylcarbamoylamino)-2-oxoethyl]azanium Traditional Name: ethyl-(3-fluoro-4-methoxy-benzyl)-[2-(isobutylcarbamoylamino)-2-keto-ethyl]ammonium Formula: C17H27FN3O3+ MolecularWeight: 340.412983

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC(=O)NCC(C)C

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C17H26FN3O3/c1-5-21(10-13-6-7-15(24-4)14(18)8-13)11-16(22)20-17(23)19-9-12(2)3/h6-8,12H,5,9-11H2,1-4H3,(H2,19,20,22,23)/p+1