(E)-3-[4-bromanyl-2-[methyl(oxan-4-yl)amino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-[methyl(oxan-4-yl)amino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-[methyl(tetrahydropyran-4-yl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-[methyl(4-oxanyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-[methyl(oxan-4-yl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-[methyl(tetrahydropyran-4-yl)amino]phenyl]acrylic acid Formula: C15H18BrNO3 MolecularWeight: 340.21232

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)C2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

CN(C1CCOCC1)C2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C15H18BrNO3/c1-17(13-6-8-20-9-7-13)14-10-12(16)4-2-11(14)3-5-15(18)19/h2-5,10,13H,6-9H2,1H3,(H,18,19)/b5-3+