(E)-3-[2-(azepan-1-yl)-5-fluoranyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(azepan-1-yl)-5-fluoranyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(azepan-1-yl)-5-fluoro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(1-azepanyl)-5-fluorophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(azepan-1-yl)-5-fluorophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(azepan-1-yl)-5-fluoro-phenyl]acrylic acid Formula: C15H18FNO2 MolecularWeight: 263.307323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)F)C=CC(=O)O

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)F)/C=C/C(=O)O

InChI

InChI=1S/C15H18FNO2/c16-13-6-7-14(12(11-13)5-8-15(18)19)17-9-3-1-2-4-10-17/h5-8,11H,1-4,9-10H2,(H,18,19)/b8-5+