5-bromanyl-2-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 5-bromanyl-2-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 5-bromo-2-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 5-bromo-2-[[(E)-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[(E)-3-(2-methoxyphenyl)acryloyl]amino]benzoic acid Formula: C17H14BrNO4 MolecularWeight: 376.20136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1/C=C/C(=O)NC2=C(C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C17H14BrNO4/c1-23-15-5-3-2-4-11(15)6-9-16(20)19-14-8-7-12(18)10-13(14)17(21)22/h2-10H,1H3,(H,19,20)(H,21,22)/b9-6+