[3-[(4-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: [3-[(4-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: [3-(4-carbamoylanilino)-3-oxo-propyl]-ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: [3-(4-carbamoylanilino)-3-oxopropyl]-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: [3-(4-carbamoylanilino)-3-oxopropyl]-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: [3-(4-carbamoylanilino)-3-keto-propyl]-ethyl-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C20H25FN3O3+ MolecularWeight: 374.429203

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)NC1=CC=C(C=C1)C(=O)N)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC[NH+](CCC(=O)NC1=CC=C(C=C1)C(=O)N)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C20H24FN3O3/c1-3-24(13-14-4-9-18(27-2)17(21)12-14)11-10-19(25)23-16-7-5-15(6-8-16)20(22)26/h4-9,12H,3,10-11,13H2,1-2H3,(H2,22,26)(H,23,25)/p+1