tert-butyl 5-[4-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-2,6-dimethyl-phenoxy]-3-pentyl-indazole-1-carboxylate

Systemtic Name: tert-butyl 5-[4-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-2,6-dimethyl-phenoxy]-3-pentyl-indazole-1-carboxylate Openeye Name: tert-butyl 5-[4-[(2-ethoxy-2-oxo-acetyl)amino]-2,6-dimethyl-phenoxy]-3-pentyl-indazole-1-carboxylate CAS Name: 5-[4-[(2-ethoxy-1,2-dioxoethyl)amino]-2,6-dimethylphenoxy]-3-pentyl-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[4-[(2-ethoxy-2-oxoacetyl)amino]-2,6-dimethylphenoxy]-3-pentylindazole-1-carboxylate Traditional Name: 3-amyl-5-[4-(ethoxalylamino)-2,6-dimethyl-phenoxy]indazole-1-carboxylic acid tert-butyl ester Formula: C29H37N3O6 MolecularWeight: 523.62058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(C2=C1C=C(C=C2)OC3=C(C=C(C=C3C)NC(=O)C(=O)OCC)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC1=NN(C2=C1C=C(C=C2)OC3=C(C=C(C=C3C)NC(=O)C(=O)OCC)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H37N3O6/c1-8-10-11-12-23-22-17-21(13-14-24(22)32(31-23)28(35)38-29(5,6)7)37-25-18(3)15-20(16-19(25)4)30-26(33)27(34)36-9-2/h13-17H,8-12H2,1-7H3,(H,30,33)