5-[2-[(3-oxidanyl-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid

Systemtic Name: 5-[2-[(3-oxidanyl-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Openeye Name: 5-[[2-[[1-(hydroxymethyl)-2-oxo-2-pyrrolidin-1-yl-ethyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid CAS Name: 5-[[2-[[[[3-hydroxy-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]amino]-oxomethyl]amino]-4-pyridinyl]oxy]-1-indolecarboxylic acid IUPAC Name: 5-[2-[(3-hydroxy-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Traditional Name: 5-[[2-[(2-keto-1-methylol-2-pyrrolidino-ethyl)carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid Formula: C22H23N5O6 MolecularWeight: 453.44792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(CO)NC(=O)NC2=NC=CC(=C2)OC3=CC4=C(C=C3)N(C=C4)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)C(CO)NC(=O)NC2=NC=CC(=C2)OC3=CC4=C(C=C3)N(C=C4)C(=O)O

InChI

InChI=1S/C22H23N5O6/c28-13-17(20(29)26-8-1-2-9-26)24-21(30)25-19-12-16(5-7-23-19)33-15-3-4-18-14(11-15)6-10-27(18)22(31)32/h3-7,10-12,17,28H,1-2,8-9,13H2,(H,31,32)(H2,23,24,25,30)