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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26FN3O3/c1-12(2)7-8-19-17(23)20-16(22)11-21(3)10-13-5-6-15(24-4)14(18)9-13/h5-6,9,12H,7-8,10-11H2,1-4H3,(H2,19,20,22,23)/p+1