tert-butyl 5-[4-(2-methanoylbutanoyloxyamino)-2,6-dimethyl-phenoxy]-3-pentyl-indazole-1-carboxylate

Systemtic Name: tert-butyl 5-[4-(2-methanoylbutanoyloxyamino)-2,6-dimethyl-phenoxy]-3-pentyl-indazole-1-carboxylate Openeye Name: tert-butyl 5-[4-(2-formylbutanoyloxyamino)-2,6-dimethyl-phenoxy]-3-pentyl-indazole-1-carboxylate CAS Name: 5-[4-[(2-formyl-1-oxobutoxy)amino]-2,6-dimethylphenoxy]-3-pentyl-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[4-(2-formylbutanoyloxyamino)-2,6-dimethylphenoxy]-3-pentylindazole-1-carboxylate Traditional Name: 3-amyl-5-[4-(2-formylbutanoyloxyamino)-2,6-dimethyl-phenoxy]indazole-1-carboxylic acid tert-butyl ester Formula: C30H39N3O6 MolecularWeight: 537.64716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(C2=C1C=C(C=C2)OC3=C(C=C(C=C3C)NOC(=O)C(CC)C=O)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC1=NN(C2=C1C=C(C=C2)OC3=C(C=C(C=C3C)NOC(=O)C(CC)C=O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H39N3O6/c1-8-10-11-12-25-24-17-23(13-14-26(24)33(31-25)29(36)38-30(5,6)7)37-27-19(3)15-22(16-20(27)4)32-39-28(35)21(9-2)18-34/h13-18,21,32H,8-12H2,1-7H3