2-[4-[3-[(3-bromophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-[(3-bromophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[3-(3-bromoanilino)-2-cyano-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[3-(3-bromoanilino)-2-cyano-3-keto-prop-1-enyl]-2-methoxy-phenoxy]acetic acid Formula: C19H15BrN2O5 MolecularWeight: 431.2368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)Br)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)Br)OCC(=O)O

InChI

InChI=1S/C19H15BrN2O5/c1-26-17-8-12(5-6-16(17)27-11-18(23)24)7-13(10-21)19(25)22-15-4-2-3-14(20)9-15/h2-9H,11H2,1H3,(H,22,25)(H,23,24)