(E)-2-acetamido-3-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(3-bromo-5-ethoxy-4-propoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(3-bromo-5-ethoxy-4-propoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(3-bromo-5-ethoxy-4-propoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(3-bromo-5-ethoxy-4-propoxy-phenyl)acrylic acid Formula: C16H20BrNO5 MolecularWeight: 386.2377

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C(C(=O)O)NC(=O)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C(\C(=O)O)/NC(=O)C)OCC

InChI

InChI=1S/C16H20BrNO5/c1-4-6-23-15-12(17)7-11(9-14(15)22-5-2)8-13(16(20)21)18-10(3)19/h7-9H,4-6H2,1-3H3,(H,18,19)(H,20,21)/b13-8+