5-[2-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid

Systemtic Name: 5-[2-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Openeye Name: 5-[[2-[(1-carbamoyl-3-methyl-butyl)carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid CAS Name: 5-[[2-[[[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-oxomethyl]amino]-4-pyridinyl]oxy]-1-indolecarboxylic acid IUPAC Name: 5-[2-[(1-amino-4-methyl-1-oxopentan-2-yl)carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Traditional Name: 5-[[2-[(1-carbamoyl-3-methyl-butyl)carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid Formula: C21H23N5O5 MolecularWeight: 425.43782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)NC1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C=C3)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)NC1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C=C3)C(=O)O

InChI

InChI=1S/C21H23N5O5/c1-12(2)9-16(19(22)27)24-20(28)25-18-11-15(5-7-23-18)31-14-3-4-17-13(10-14)6-8-26(17)21(29)30/h3-8,10-12,16H,9H2,1-2H3,(H2,22,27)(H,29,30)(H2,23,24,25,28)