(4-fluorophenyl)methyl-methyl-[(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (4-fluorophenyl)methyl-methyl-[(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-fluorophenyl)methyl-methyl-[(1S)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl]ammonium CAS Name: (4-fluorophenyl)methyl-methyl-[(2S)-1-(3-methylanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: (4-fluorophenyl)methyl-methyl-[(2S)-1-(3-methylanilino)-1-oxopropan-2-yl]azanium Traditional Name: (4-fluorobenzyl)-[(1S)-2-keto-1-methyl-2-(m-toluidino)ethyl]-methyl-ammonium Formula: C18H22FN2O+ MolecularWeight: 301.378483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21FN2O/c1-13-5-4-6-17(11-13)20-18(22)14(2)21(3)12-15-7-9-16(19)10-8-15/h4-11,14H,12H2,1-3H3,(H,20,22)/p+1/t14-/m0/s1