3-[4-(5-pentylpyridin-2-yl)phenyl]prop-2-enoic acid

Systemtic Name: 3-[4-(5-pentylpyridin-2-yl)phenyl]prop-2-enoic acid Openeye Name: 3-[4-(5-pentyl-2-pyridyl)phenyl]prop-2-enoic acid CAS Name: 3-[4-(5-pentyl-2-pyridinyl)phenyl]-2-propenoic acid IUPAC Name: 3-[4-(5-pentylpyridin-2-yl)phenyl]prop-2-enoic acid Traditional Name: 3-[4-(5-amyl-2-pyridyl)phenyl]acrylic acid Formula: C19H21NO2 MolecularWeight: 295.37554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C=CC(=O)O

InChI

InChI=1S/C19H21NO2/c1-2-3-4-5-16-8-12-18(20-14-16)17-10-6-15(7-11-17)9-13-19(21)22/h6-14H,2-5H2,1H3,(H,21,22)