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

Systemtic Name: tert-butyl 5-(4-azanyl-2,6-dimethyl-phenoxy)-3-pentyl-indazole-1-carboxylate Openeye Name: tert-butyl 5-(4-amino-2,6-dimethyl-phenoxy)-3-pentyl-indazole-1-carboxylate CAS Name: 5-(4-amino-2,6-dimethylphenoxy)-3-pentyl-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(4-amino-2,6-dimethylphenoxy)-3-pentylindazole-1-carboxylate Traditional Name: 5-(4-amino-2,6-dimethyl-phenoxy)-3-amyl-indazole-1-carboxylic acid tert-butyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c1-7-8-9-10-21-20-15-19(30-23-16(2)13-18(26)14-17(23)3)11-12-22(20)28(27-21)24(29)31-25(4,5)6/h11-15H,7-10,26H2,1-6H3