N-[2-[2,5-bis(oxidanylidene)pyrrol-1-yl]ethyl]-6-bromanyl-7-(diethylamino)-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[2-[2,5-bis(oxidanylidene)pyrrol-1-yl]ethyl]-6-bromanyl-7-(diethylamino)-2-oxidanylidene-chromene-3-carboxamide Openeye Name: 6-bromo-7-(diethylamino)-N-[2-(2,5-dioxopyrrol-1-yl)ethyl]-2-oxo-chromene-3-carboxamide CAS Name: 6-bromo-7-(diethylamino)-N-[2-(2,5-dioxo-1-pyrrolyl)ethyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: 6-bromo-7-(diethylamino)-N-[2-(2,5-dioxopyrrol-1-yl)ethyl]-2-oxochromene-3-carboxamide Traditional Name: 6-bromo-7-(diethylamino)-2-keto-N-(2-maleimidoethyl)chromene-3-carboxamide Formula: C20H20BrN3O5 MolecularWeight: 462.2939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C2C=C(C(=O)OC2=C1)C(=O)NCCN3C(=O)C=CC3=O)Br

Isomeric SMILES

CCN(CC)C1=C(C=C2C=C(C(=O)OC2=C1)C(=O)NCCN3C(=O)C=CC3=O)Br

InChI

InChI=1S/C20H20BrN3O5/c1-3-23(4-2)15-11-16-12(10-14(15)21)9-13(20(28)29-16)19(27)22-7-8-24-17(25)5-6-18(24)26/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,22,27)