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

Systemtic Name: 4-[4-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]butanoate Openeye Name: 4-(4-bromo-2,3-dioxo-indolin-1-yl)butanoate CAS Name: 4-(4-bromo-2,3-dioxo-1-indolyl)butanoate IUPAC Name: 4-(4-bromo-2,3-dioxoindol-1-yl)butanoate Traditional Name: 4-(4-bromo-2,3-diketo-indolin-1-yl)butyrate Formula: C12H9BrNO4- MolecularWeight: 311.10816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2CCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2CCCC(=O)[O-]

InChI

InChI=1S/C12H10BrNO4/c13-7-3-1-4-8-10(7)11(17)12(18)14(8)6-2-5-9(15)16/h1,3-4H,2,5-6H2,(H,15,16)/p-1