(E)-3-[4-bromanyl-2-(dibutylamino)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-(dibutylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-(dibutylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(dibutylamino)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-(dibutylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-(dibutylamino)phenyl]acrylic acid Formula: C17H24BrNO2 MolecularWeight: 354.28196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C=CC(=C1)Br)C=CC(=O)O

Isomeric SMILES

CCCCN(CCCC)C1=C(C=CC(=C1)Br)/C=C/C(=O)O

InChI

InChI=1S/C17H24BrNO2/c1-3-5-11-19(12-6-4-2)16-13-15(18)9-7-14(16)8-10-17(20)21/h7-10,13H,3-6,11-12H2,1-2H3,(H,20,21)/b10-8+