[3-acetamido-5-[(2-fluorophenyl)carbamoyl]phenyl]methyl-[(2S)-2-phenylpropyl]azanium

Systemtic Name: [3-acetamido-5-[(2-fluorophenyl)carbamoyl]phenyl]methyl-[(2S)-2-phenylpropyl]azanium Openeye Name: [3-acetamido-5-[(2-fluorophenyl)carbamoyl]phenyl]methyl-[(2S)-2-phenylpropyl]ammonium CAS Name: [3-acetamido-5-[(2-fluoroanilino)-oxomethyl]phenyl]methyl-[(2S)-2-phenylpropyl]ammonium IUPAC Name: [3-acetamido-5-[(2-fluorophenyl)carbamoyl]phenyl]methyl-[(2S)-2-phenylpropyl]azanium Traditional Name: [3-acetamido-5-[(2-fluorophenyl)carbamoyl]benzyl]-[(2S)-2-phenylpropyl]ammonium Formula: C25H27FN3O2+ MolecularWeight: 420.499183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1=CC(=CC(=C1)C(=O)NC2=CC=CC=C2F)NC(=O)C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C[NH2+]CC1=CC(=CC(=C1)C(=O)NC2=CC=CC=C2F)NC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C25H26FN3O2/c1-17(20-8-4-3-5-9-20)15-27-16-19-12-21(14-22(13-19)28-18(2)30)25(31)29-24-11-7-6-10-23(24)26/h3-14,17,27H,15-16H2,1-2H3,(H,28,30)(H,29,31)/p+1/t17-/m1/s1