4-[2-(3-bromanyl-4-prop-2-ynoxy-phenyl)-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-(3-bromanyl-4-prop-2-ynoxy-phenyl)-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[2-(3-bromo-4-prop-2-ynoxy-phenyl)-1-cyano-vinyl]benzoic acid CAS Name: 4-[2-(3-bromo-4-prop-2-ynoxyphenyl)-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-(3-bromo-4-prop-2-ynoxyphenyl)-1-cyanoethenyl]benzoic acid Traditional Name: 4-[2-(3-bromo-4-propargyloxy-phenyl)-1-cyano-vinyl]benzoic acid Formula: C19H12BrNO3 MolecularWeight: 382.20748

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)Br

Isomeric SMILES

C#CCOC1=C(C=C(C=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C19H12BrNO3/c1-2-9-24-18-8-3-13(11-17(18)20)10-16(12-21)14-4-6-15(7-5-14)19(22)23/h1,3-8,10-11H,9H2,(H,22,23)