3-[3-methylbutyl-[4-[(2S)-non-4-yn-2-yl]oxybut-2-ynyl]amino]propanenitrile

Systemtic Name: 3-[3-methylbutyl-[4-[(2S)-non-4-yn-2-yl]oxybut-2-ynyl]amino]propanenitrile Openeye Name: 3-[isopentyl-[4-[(1S)-1-methyloct-3-ynoxy]but-2-ynyl]amino]propanenitrile CAS Name: 3-[3-methylbutyl-[4-[(2S)-non-4-yn-2-yl]oxybut-2-ynyl]amino]propanenitrile IUPAC Name: 3-[3-methylbutyl-[4-[(2S)-non-4-yn-2-yl]oxybut-2-ynyl]amino]propanenitrile Traditional Name: 3-[isoamyl-[4-[(1S)-1-methyloct-3-ynoxy]but-2-ynyl]amino]propionitrile Formula: C21H34N2O MolecularWeight: 330.50746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCC(C)OCC#CCN(CCC#N)CCC(C)C

Isomeric SMILES

CCCCC#CC[C@H](C)OCC#CCN(CCC#N)CCC(C)C

InChI

InChI=1S/C21H34N2O/c1-5-6-7-8-9-13-21(4)24-19-11-10-16-23(17-12-15-22)18-14-20(2)3/h20-21H,5-7,12-14,16-19H2,1-4H3/t21-/m0/s1