(E)-3-[5-bromanyl-2-[2-(cyclopropylamino)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-bromanyl-2-[2-(cyclopropylamino)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[5-bromo-2-[2-(cyclopropylamino)-2-oxo-ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[5-bromo-2-[2-(cyclopropylamino)-2-oxoethoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-bromo-2-[2-(cyclopropylamino)-2-oxoethoxy]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[5-bromo-2-[2-(cyclopropylamino)-2-keto-ethoxy]phenyl]acrylic acid Formula: C14H14BrNO4 MolecularWeight: 340.16926

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC2=C(C=C(C=C2)Br)C=CC(=O)O

Isomeric SMILES

C1CC1NC(=O)COC2=C(C=C(C=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C14H14BrNO4/c15-10-2-5-12(9(7-10)1-6-14(18)19)20-8-13(17)16-11-3-4-11/h1-2,5-7,11H,3-4,8H2,(H,16,17)(H,18,19)/b6-1+