3-methylbutyl-[(2S)-octan-2-yl]azanium

Systemtic Name: 3-methylbutyl-[(2S)-octan-2-yl]azanium Openeye Name: isopentyl-[(1S)-1-methylheptyl]ammonium CAS Name: 3-methylbutyl-[(2S)-octan-2-yl]ammonium IUPAC Name: 3-methylbutyl-[(2S)-octan-2-yl]azanium Traditional Name: isoamyl-[(1S)-1-methylheptyl]ammonium Formula: C13H30N+ MolecularWeight: 200.384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]CCC(C)C

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]CCC(C)C

InChI

InChI=1S/C13H29N/c1-5-6-7-8-9-13(4)14-11-10-12(2)3/h12-14H,5-11H2,1-4H3/p+1/t13-/m0/s1