2-[[(2S)-2-azanyl-6-[(4-fluorophenyl)carbonylamino]hexanoyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[(2S)-2-azanyl-6-[(4-fluorophenyl)carbonylamino]hexanoyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[(2S)-2-amino-6-[(4-fluorobenzoyl)amino]hexanoyl]-methyl-amino]acetic acid CAS Name: 2-[[(2S)-2-amino-6-[[(4-fluorophenyl)-oxomethyl]amino]-1-oxohexyl]-methylamino]acetic acid IUPAC Name: 2-[[(2S)-2-amino-6-[(4-fluorobenzoyl)amino]hexanoyl]-methylamino]acetic acid Traditional Name: 2-[[(2S)-2-amino-6-[(4-fluorobenzoyl)amino]hexanoyl]-methyl-amino]acetic acid Formula: C16H22FN3O4 MolecularWeight: 339.361983

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C(CCCCNC(=O)C1=CC=C(C=C1)F)N

Isomeric SMILES

CN(CC(=O)O)C(=O)[C@H](CCCCNC(=O)C1=CC=C(C=C1)F)N

InChI

InChI=1S/C16H22FN3O4/c1-20(10-14(21)22)16(24)13(18)4-2-3-9-19-15(23)11-5-7-12(17)8-6-11/h5-8,13H,2-4,9-10,18H2,1H3,(H,19,23)(H,21,22)/t13-/m0/s1