2-[[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[(E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[(E)-3-(2-chloro-6-fluorophenyl)-1-oxoprop-2-enyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[(E)-3-(2-chloro-6-fluoro-phenyl)acryloyl]amino]-4-methyl-valeric acid Formula: C15H17ClFNO3 MolecularWeight: 313.751783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C=CC1=C(C=CC=C1Cl)F

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)/C=C/C1=C(C=CC=C1Cl)F

InChI

InChI=1S/C15H17ClFNO3/c1-9(2)8-13(15(20)21)18-14(19)7-6-10-11(16)4-3-5-12(10)17/h3-7,9,13H,8H2,1-2H3,(H,18,19)(H,20,21)/b7-6+