4-[[(E)-3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[(E)-3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E)-3-(5-bromo-2-ethoxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E)-3-(5-bromo-2-ethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E)-3-(5-bromo-2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(5-bromo-2-ethoxy-phenyl)acryloyl]amino]benzoic acid Formula: C18H16BrNO4 MolecularWeight: 390.22794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H16BrNO4/c1-2-24-16-9-6-14(19)11-13(16)5-10-17(21)20-15-7-3-12(4-8-15)18(22)23/h3-11H,2H2,1H3,(H,20,21)(H,22,23)/b10-5+