1-[[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]cyclopentane-1-carboxylic acid Openeye Name: 1-[[(E)-3-(3-chloro-4-fluoro-phenyl)prop-2-enoyl]amino]cyclopentanecarboxylic acid CAS Name: 1-[[(E)-3-(3-chloro-4-fluorophenyl)-1-oxoprop-2-enyl]amino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[[(E)-3-(3-chloro-4-fluorophenyl)prop-2-enoyl]amino]cyclopentane-1-carboxylic acid Traditional Name: 1-[[(E)-3-(3-chloro-4-fluoro-phenyl)acryloyl]amino]cyclopentanecarboxylic acid Formula: C15H15ClFNO3 MolecularWeight: 311.735903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)O)NC(=O)C=CC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1CCC(C1)(C(=O)O)NC(=O)/C=C/C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H15ClFNO3/c16-11-9-10(3-5-12(11)17)4-6-13(19)18-15(14(20)21)7-1-2-8-15/h3-6,9H,1-2,7-8H2,(H,18,19)(H,20,21)/b6-4+