5-[(E)-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-[(E)-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 5-[(E)-(5-bromo-2-oxo-indolin-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid CAS Name: 5-[(E)-(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-[(E)-(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 5-[(E)-(5-bromo-2-keto-indolin-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid Formula: C14H9BrN2O3 MolecularWeight: 333.13686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CC3=CC=C(N3)C(=O)O)C(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1Br)/C(=C\C3=CC=C(N3)C(=O)O)/C(=O)N2

InChI

InChI=1S/C14H9BrN2O3/c15-7-1-3-11-9(5-7)10(13(18)17-11)6-8-2-4-12(16-8)14(19)20/h1-6,16H,(H,17,18)(H,19,20)/b10-6+