[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]-[2-(indan-5-ylamino)-2-oxo-ethyl]ammonium CAS Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: ethyl-(3-fluoro-4-methoxy-benzyl)-[2-(indan-5-ylamino)-2-keto-ethyl]ammonium Formula: C21H26FN2O2+ MolecularWeight: 357.441743

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H25FN2O2/c1-3-24(13-15-7-10-20(26-2)19(22)11-15)14-21(25)23-18-9-8-16-5-4-6-17(16)12-18/h7-12H,3-6,13-14H2,1-2H3,(H,23,25)/p+1