5-[2-[[3-(cyclopropylamino)-3-oxidanylidene-propyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid

Systemtic Name: 5-[2-[[3-(cyclopropylamino)-3-oxidanylidene-propyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Openeye Name: 5-[[2-[[3-(cyclopropylamino)-3-oxo-propyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid CAS Name: 5-[[2-[[[[3-(cyclopropylamino)-3-oxopropyl]amino]-oxomethyl]amino]-4-pyridinyl]oxy]-1-indolecarboxylic acid IUPAC Name: 5-[2-[[3-(cyclopropylamino)-3-oxopropyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Traditional Name: 5-[[2-[[3-(cyclopropylamino)-3-keto-propyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid Formula: C21H21N5O5 MolecularWeight: 423.42194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O5/c27-19(24-14-1-2-14)6-9-23-20(28)25-18-12-16(5-8-22-18)31-15-3-4-17-13(11-15)7-10-26(17)21(29)30/h3-5,7-8,10-12,14H,1-2,6,9H2,(H,24,27)(H,29,30)(H2,22,23,25,28)