2-azanyl-4-(5-bromanyl-1H-indol-2-yl)-2-oxidanyl-4-oxidanylidene-3-(phenylmethyl)butanoic acid

Systemtic Name: 2-azanyl-4-(5-bromanyl-1H-indol-2-yl)-2-oxidanyl-4-oxidanylidene-3-(phenylmethyl)butanoic acid Openeye Name: 2-amino-3-benzyl-4-(5-bromo-1H-indol-2-yl)-2-hydroxy-4-oxo-butanoic acid CAS Name: 2-amino-4-(5-bromo-1H-indol-2-yl)-2-hydroxy-4-oxo-3-(phenylmethyl)butanoic acid IUPAC Name: 2-amino-3-benzyl-4-(5-bromo-1H-indol-2-yl)-2-hydroxy-4-oxobutanoic acid Traditional Name: 2-amino-3-benzyl-4-(5-bromo-1H-indol-2-yl)-2-hydroxy-4-keto-butyric acid Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)C2=CC3=C(N2)C=CC(=C3)Br)C(C(=O)O)(N)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)C2=CC3=C(N2)C=CC(=C3)Br)C(C(=O)O)(N)O

InChI

InChI=1S/C19H17BrN2O4/c20-13-6-7-15-12(9-13)10-16(22-15)17(23)14(19(21,26)18(24)25)8-11-4-2-1-3-5-11/h1-7,9-10,14,22,26H,8,21H2,(H,24,25)