5-[4-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]pentanoate

Systemtic Name: 5-[4-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]pentanoate Openeye Name: 5-(4-bromo-2,3-dioxo-indolin-1-yl)pentanoate CAS Name: 5-(4-bromo-2,3-dioxo-1-indolyl)pentanoate IUPAC Name: 5-(4-bromo-2,3-dioxoindol-1-yl)pentanoate Traditional Name: 5-(4-bromo-2,3-diketo-indolin-1-yl)valerate Formula: C13H11BrNO4- MolecularWeight: 325.13474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2CCCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2CCCCC(=O)[O-]

InChI

InChI=1S/C13H12BrNO4/c14-8-4-3-5-9-11(8)12(18)13(19)15(9)7-2-1-6-10(16)17/h3-5H,1-2,6-7H2,(H,16,17)/p-1