2-[4-[(E)-3-(4-bromophenyl)prop-2-enoxy]pyridin-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[(E)-3-(4-bromophenyl)prop-2-enoxy]pyridin-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[(E)-3-(4-bromophenyl)allyloxy]-3-pyridyl]-2-oxo-acetic acid CAS Name: 2-[4-[(E)-3-(4-bromophenyl)prop-2-enoxy]-3-pyridinyl]-2-oxoacetic acid IUPAC Name: 2-[4-[(E)-3-(4-bromophenyl)prop-2-enoxy]pyridin-3-yl]-2-oxoacetic acid Traditional Name: 2-[4-[(E)-3-(4-bromophenyl)allyloxy]-3-pyridyl]-2-keto-acetic acid Formula: C16H12BrNO4 MolecularWeight: 362.17478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CCOC2=C(C=NC=C2)C(=O)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1/C=C/COC2=C(C=NC=C2)C(=O)C(=O)O)Br

InChI

InChI=1S/C16H12BrNO4/c17-12-5-3-11(4-6-12)2-1-9-22-14-7-8-18-10-13(14)15(19)16(20)21/h1-8,10H,9H2,(H,20,21)/b2-1+