(E)-3-[2-[(4-ethoxyphenyl)amino]pyrimidin-5-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-[(4-ethoxyphenyl)amino]pyrimidin-5-yl]prop-2-enoic acid Openeye Name: (E)-3-[2-(4-ethoxyanilino)pyrimidin-5-yl]prop-2-enoic acid CAS Name: (E)-3-[2-(4-ethoxyanilino)-5-pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(4-ethoxyanilino)pyrimidin-5-yl]prop-2-enoic acid Traditional Name: (E)-3-[2-(p-phenetidino)pyrimidin-5-yl]acrylic acid Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC=C(C=N2)C=CC(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC=C(C=N2)/C=C/C(=O)O

InChI

InChI=1S/C15H15N3O3/c1-2-21-13-6-4-12(5-7-13)18-15-16-9-11(10-17-15)3-8-14(19)20/h3-10H,2H2,1H3,(H,19,20)(H,16,17,18)/b8-3+