(E)-3-(6-oxidanylidene-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-2-phenyl-prop-2-enoic acid

Systemtic Name: (E)-3-(6-oxidanylidene-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-2-phenyl-prop-2-enoic acid Openeye Name: (E)-3-(6-oxo-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-2-phenyl-prop-2-enoic acid CAS Name: (E)-3-(6-oxo-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-2-phenyl-2-propenoic acid IUPAC Name: (E)-3-(6-oxo-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-2-phenylprop-2-enoic acid Traditional Name: (E)-3-(6-keto-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-2-phenyl-acrylic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=CNC3=C2C=CC(=O)N3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=CNC3=C2C=CC(=O)N3)/C(=O)O

InChI

InChI=1S/C16H12N2O3/c19-14-7-6-12-11(9-17-15(12)18-14)8-13(16(20)21)10-4-2-1-3-5-10/h1-9H,(H,20,21)(H2,17,18,19)/b13-8+