2-[[2-(5-bromanyl-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-[[2-(5-bromanyl-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-[[2-(5-bromo-1H-indol-3-yl)-2-oxo-acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[2-(5-bromo-1H-indol-3-yl)-1,2-dioxoethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[[2-(5-bromo-1H-indol-3-yl)-2-oxoacetyl]amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[[2-(5-bromo-1H-indol-3-yl)-2-keto-acetyl]amino]-3-(4-hydroxyphenyl)propionic acid Formula: C19H15BrN2O5 MolecularWeight: 431.2368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C(=O)C2=CNC3=C2C=C(C=C3)Br)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C(=O)C2=CNC3=C2C=C(C=C3)Br)O

InChI

InChI=1S/C19H15BrN2O5/c20-11-3-6-15-13(8-11)14(9-21-15)17(24)18(25)22-16(19(26)27)7-10-1-4-12(23)5-2-10/h1-6,8-9,16,21,23H,7H2,(H,22,25)(H,26,27)