1-[3-[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-yl-amino]propyl]indazole-5-carboxylic acid

Systemtic Name: 1-[3-[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-yl-amino]propyl]indazole-5-carboxylic acid Openeye Name: 1-[3-[tert-butoxycarbonyl(2-pyridyl)amino]propyl]indazole-5-carboxylic acid CAS Name: 1-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(2-pyridinyl)amino]propyl]-5-indazolecarboxylic acid IUPAC Name: 1-[3-[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-ylamino]propyl]indazole-5-carboxylic acid Traditional Name: 1-[3-[tert-butoxycarbonyl(2-pyridyl)amino]propyl]indazole-5-carboxylic acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCN1C2=C(C=C(C=C2)C(=O)O)C=N1)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCN1C2=C(C=C(C=C2)C(=O)O)C=N1)C3=CC=CC=N3

InChI

InChI=1S/C21H24N4O4/c1-21(2,3)29-20(28)24(18-7-4-5-10-22-18)11-6-12-25-17-9-8-15(19(26)27)13-16(17)14-23-25/h4-5,7-10,13-14H,6,11-12H2,1-3H3,(H,26,27)