(E)-3-[5-bromanyl-2-[2-oxidanylidene-2-(propan-2-ylamino)ethoxy]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[5-bromanyl-2-[2-oxidanylidene-2-(propan-2-ylamino)ethoxy]phenyl]prop-2-enoate Openeye Name: (E)-3-[5-bromo-2-[2-(isopropylamino)-2-oxo-ethoxy]phenyl]prop-2-enoate CAS Name: (E)-3-[5-bromo-2-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]-2-propenoate IUPAC Name: (E)-3-[5-bromo-2-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]prop-2-enoate Traditional Name: (E)-3-[5-bromo-2-[2-(isopropylamino)-2-keto-ethoxy]phenyl]acrylate Formula: C14H15BrNO4- MolecularWeight: 341.1772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC1=C(C=C(C=C1)Br)C=CC(=O)[O-]

Isomeric SMILES

CC(C)NC(=O)COC1=C(C=C(C=C1)Br)/C=C/C(=O)[O-]

InChI

InChI=1S/C14H16BrNO4/c1-9(2)16-13(17)8-20-12-5-4-11(15)7-10(12)3-6-14(18)19/h3-7,9H,8H2,1-2H3,(H,16,17)(H,18,19)/p-1/b6-3+