[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [2-(2-fluoro-4-methyl-anilino)-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [2-(2-fluoro-4-methyl-anilino)-2-keto-ethyl]-(4-isopropylbenzyl)-methyl-ammonium Formula: C20H26FN2O+ MolecularWeight: 329.431643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C)F

InChI

InChI=1S/C20H25FN2O/c1-14(2)17-8-6-16(7-9-17)12-23(4)13-20(24)22-19-10-5-15(3)11-18(19)21/h5-11,14H,12-13H2,1-4H3,(H,22,24)/p+1