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

Systemtic Name: 4-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]benzoic acid Formula: C17H14BrNO4 MolecularWeight: 376.20136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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