[(2S)-2-ethylhexyl]-[(1-methylpyrrol-2-yl)methyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[(1-methylpyrrol-2-yl)methyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(1-methylpyrrol-2-yl)methyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[(1-methyl-2-pyrrolyl)methyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[(1-methylpyrrol-2-yl)methyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[(1-methylpyrrol-2-yl)methyl]ammonium Formula: C14H27N2+ MolecularWeight: 223.37758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]CC1=CC=CN1C

Isomeric SMILES

CCCC[C@H](CC)C[NH2+]CC1=CC=CN1C

InChI

InChI=1S/C14H26N2/c1-4-6-8-13(5-2)11-15-12-14-9-7-10-16(14)3/h7,9-10,13,15H,4-6,8,11-12H2,1-3H3/p+1/t13-/m0/s1