(2S)-1-[1-(6-bromanyl-1H-indol-3-yl)-2-oxidanyl-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[1-(6-bromanyl-1H-indol-3-yl)-2-oxidanyl-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[1-(6-bromo-1H-indol-3-yl)-2-hydroxy-2-oxo-ethyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[1-(6-bromo-1H-indol-3-yl)-2-hydroxy-2-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[1-(6-bromo-1H-indol-3-yl)-2-hydroxy-2-oxoethyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[1-(6-bromo-1H-indol-3-yl)-2-hydroxy-2-keto-ethyl]proline Formula: C15H15BrN2O4 MolecularWeight: 367.1946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C[C@H](N(C1)C(C2=CNC3=C2C=CC(=C3)Br)C(=O)O)C(=O)O

InChI

InChI=1S/C15H15BrN2O4/c16-8-3-4-9-10(7-17-11(9)6-8)13(15(21)22)18-5-1-2-12(18)14(19)20/h3-4,6-7,12-13,17H,1-2,5H2,(H,19,20)(H,21,22)/t12-,13?/m0/s1