(E)-3-[3,5-dimethyl-4-(pyridin-4-ylmethoxy)phenyl]prop-2-enoate

Systemtic Name: (E)-3-[3,5-dimethyl-4-(pyridin-4-ylmethoxy)phenyl]prop-2-enoate Openeye Name: (E)-3-[3,5-dimethyl-4-(4-pyridylmethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[3,5-dimethyl-4-(pyridin-4-ylmethoxy)phenyl]-2-propenoate IUPAC Name: (E)-3-[3,5-dimethyl-4-(pyridin-4-ylmethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[3,5-dimethyl-4-(4-pyridylmethoxy)phenyl]acrylate Formula: C17H16NO3- MolecularWeight: 282.31384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=NC=C2)C)C=CC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=NC=C2)C)/C=C/C(=O)[O-]

InChI

InChI=1S/C17H17NO3/c1-12-9-15(3-4-16(19)20)10-13(2)17(12)21-11-14-5-7-18-8-6-14/h3-10H,11H2,1-2H3,(H,19,20)/p-1/b4-3+