[(3S,5S)-5-methylheptan-3-yl]-prop-2-ynyl-azanium

Systemtic Name: [(3S,5S)-5-methylheptan-3-yl]-prop-2-ynyl-azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-prop-2-ynyl-ammonium CAS Name: [(3S,5S)-5-methylheptan-3-yl]-prop-2-ynylammonium IUPAC Name: [(3S,5S)-5-methylheptan-3-yl]-prop-2-ynylazanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-propargyl-ammonium Formula: C11H22N+ MolecularWeight: 168.29908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CC#C

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+]CC#C

InChI

InChI=1S/C11H21N/c1-5-8-12-11(7-3)9-10(4)6-2/h1,10-12H,6-9H2,2-4H3/p+1/t10-,11-/m0/s1