(E)-2-acetamido-3-(3-bromanyl-4,5-diethoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(3-bromanyl-4,5-diethoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(3-bromo-4,5-diethoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(3-bromo-4,5-diethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(3-bromo-4,5-diethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(3-bromo-4,5-diethoxy-phenyl)acrylic acid Formula: C15H18BrNO5 MolecularWeight: 372.21112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C(=O)O)NC(=O)C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C(=O)O)/NC(=O)C)Br)OCC

InChI

InChI=1S/C15H18BrNO5/c1-4-21-13-8-10(6-11(16)14(13)22-5-2)7-12(15(19)20)17-9(3)18/h6-8H,4-5H2,1-3H3,(H,17,18)(H,19,20)/b12-7+