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

Systemtic Name: 5-bromanyl-2-[[(E)-3-(5-chloranyl-2-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 5-bromo-2-[[(E)-3-(5-chloro-2-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 5-bromo-2-[[(E)-3-(5-chloro-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[(E)-3-(5-chloro-2-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[(E)-3-(5-chloro-2-methoxy-phenyl)acryloyl]amino]benzoic acid Formula: C17H13BrClNO4 MolecularWeight: 410.64642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrClNO4/c1-24-15-6-4-12(19)8-10(15)2-7-16(21)20-14-5-3-11(18)9-13(14)17(22)23/h2-9H,1H3,(H,20,21)(H,22,23)/b7-2+