6-(benzotriazol-1-yl)-2-(butylamino)-3-methyl-hex-4-yn-3-ol

Systemtic Name: 6-(benzotriazol-1-yl)-2-(butylamino)-3-methyl-hex-4-yn-3-ol Openeye Name: 6-(benzotriazol-1-yl)-2-(butylamino)-3-methyl-hex-4-yn-3-ol CAS Name: 6-(1-benzotriazolyl)-2-(butylamino)-3-methyl-4-hexyn-3-ol IUPAC Name: 6-(benzotriazol-1-yl)-2-(butylamino)-3-methylhex-4-yn-3-ol Traditional Name: 6-(benzotriazol-1-yl)-2-(butylamino)-3-methyl-hex-4-yn-3-ol Formula: C17H24N4O MolecularWeight: 300.39866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C)C(C)(C#CCN1C2=CC=CC=C2N=N1)O

Isomeric SMILES

CCCCNC(C)C(C)(C#CCN1C2=CC=CC=C2N=N1)O

InChI

InChI=1S/C17H24N4O/c1-4-5-12-18-14(2)17(3,22)11-8-13-21-16-10-7-6-9-15(16)19-20-21/h6-7,9-10,14,18,22H,4-5,12-13H2,1-3H3