(E)-3-[2-(2-ethylpiperidin-1-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(2-ethylpiperidin-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(2-ethyl-1-piperidyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(2-ethyl-1-piperidinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(2-ethylpiperidin-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(2-ethylpiperidino)phenyl]acrylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=CC=CC=C2C=CC(=O)O

Isomeric SMILES

CCC1CCCCN1C2=CC=CC=C2/C=C/C(=O)O

InChI

InChI=1S/C16H21NO2/c1-2-14-8-5-6-12-17(14)15-9-4-3-7-13(15)10-11-16(18)19/h3-4,7,9-11,14H,2,5-6,8,12H2,1H3,(H,18,19)/b11-10+