[2-oxidanylidene-2-(1-phenylethylamino)ethyl] 2-[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]propanoate

Systemtic Name: [2-oxidanylidene-2-(1-phenylethylamino)ethyl] 2-[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]propanoate Openeye Name: [2-oxo-2-(1-phenylethylamino)ethyl] 2-(5-bromo-2,3-dioxo-indolin-1-yl)propanoate CAS Name: 2-(5-bromo-2,3-dioxo-1-indolyl)propanoic acid [2-oxo-2-(1-phenylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylethylamino)ethyl] 2-(5-bromo-2,3-dioxoindol-1-yl)propanoate Traditional Name: 2-(5-bromo-2,3-diketo-indolin-1-yl)propionic acid [2-keto-2-(1-phenylethylamino)ethyl] ester Formula: C21H19BrN2O5 MolecularWeight: 459.28996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)COC(=O)C(C)N2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)COC(=O)C(C)N2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C21H19BrN2O5/c1-12(14-6-4-3-5-7-14)23-18(25)11-29-21(28)13(2)24-17-9-8-15(22)10-16(17)19(26)20(24)27/h3-10,12-13H,11H2,1-2H3,(H,23,25)