(2R)-2-[[(Z)-2-acetamido-3-(4-fluorophenyl)prop-2-enoyl]amino]pentanedioate

Systemtic Name: (2R)-2-[[(Z)-2-acetamido-3-(4-fluorophenyl)prop-2-enoyl]amino]pentanedioate Openeye Name: (2R)-2-[[(Z)-2-acetamido-3-(4-fluorophenyl)prop-2-enoyl]amino]pentanedioate CAS Name: (2R)-2-[[(Z)-2-acetamido-3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]pentanedioate IUPAC Name: (2R)-2-[[(Z)-2-acetamido-3-(4-fluorophenyl)prop-2-enoyl]amino]pentanedioate Traditional Name: (2R)-2-[[(Z)-2-acetamido-3-(4-fluorophenyl)acryloyl]amino]glutarate Formula: C16H15FN2O6-2 MolecularWeight: 350.298503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=C(C=C1)F)C(=O)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(=O)N/C(=C\C1=CC=C(C=C1)F)/C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H17FN2O6/c1-9(20)18-13(8-10-2-4-11(17)5-3-10)15(23)19-12(16(24)25)6-7-14(21)22/h2-5,8,12H,6-7H2,1H3,(H,18,20)(H,19,23)(H,21,22)(H,24,25)/p-2/b13-8-/t12-/m1/s1