methyl 3-[2-[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(5-bromo-2,3-dioxo-indolin-1-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(5-bromo-2,3-dioxo-1-indolyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(5-bromo-2,3-dioxoindol-1-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(5-bromo-2,3-diketo-indolin-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C18H13BrN2O5 MolecularWeight: 417.21022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C18H13BrN2O5/c1-26-18(25)10-3-2-4-12(7-10)20-15(22)9-21-14-6-5-11(19)8-13(14)16(23)17(21)24/h2-8H,9H2,1H3,(H,20,22)