(E)-3-(4-bromanyl-2-morpholin-4-yl-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-bromanyl-2-morpholin-4-yl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-bromo-2-morpholino-phenyl)prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(4-morpholinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(4-bromo-2-morpholin-4-ylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-bromo-2-morpholino-phenyl)acrylic acid Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

C1COCCN1C2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C13H14BrNO3/c14-11-3-1-10(2-4-13(16)17)12(9-11)15-5-7-18-8-6-15/h1-4,9H,5-8H2,(H,16,17)/b4-2+