5-[2-[[4-(cyclopropylamino)-4-oxidanylidene-butyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid

Systemtic Name: 5-[2-[[4-(cyclopropylamino)-4-oxidanylidene-butyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Openeye Name: 5-[[2-[[4-(cyclopropylamino)-4-oxo-butyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid CAS Name: 5-[[2-[[[[4-(cyclopropylamino)-4-oxobutyl]amino]-oxomethyl]amino]-4-pyridinyl]oxy]-1-indolecarboxylic acid IUPAC Name: 5-[2-[[4-(cyclopropylamino)-4-oxobutyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Traditional Name: 5-[[2-[[4-(cyclopropylamino)-4-keto-butyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid Formula: C22H23N5O5 MolecularWeight: 437.44852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CCCNC(=O)NC2=NC=CC(=C2)OC3=CC4=C(C=C3)N(C=C4)C(=O)O

Isomeric SMILES

C1CC1NC(=O)CCCNC(=O)NC2=NC=CC(=C2)OC3=CC4=C(C=C3)N(C=C4)C(=O)O

InChI

InChI=1S/C22H23N5O5/c28-20(25-15-3-4-15)2-1-9-24-21(29)26-19-13-17(7-10-23-19)32-16-5-6-18-14(12-16)8-11-27(18)22(30)31/h5-8,10-13,15H,1-4,9H2,(H,25,28)(H,30,31)(H2,23,24,26,29)