tert-butyl 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-oxidanylprop-1-ynyl)indazole-1-carboxylate

Systemtic Name: tert-butyl 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-oxidanylprop-1-ynyl)indazole-1-carboxylate Openeye Name: tert-butyl 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)indazole-1-carboxylate CAS Name: 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)indazole-1-carboxylate Traditional Name: 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)indazole-1-carboxylic acid tert-butyl ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)C#CCO)C(=N1)C#CCN(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)C#CCO)C(=N1)C#CCN(C)C

InChI

InChI=1S/C20H23N3O3/c1-20(2,3)26-19(25)23-18-11-10-15(8-7-13-24)14-16(18)17(21-23)9-6-12-22(4)5/h10-11,14,24H,12-13H2,1-5H3