[(2S)-2-ethylhexyl]-[(4-propoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[(4-propoxyphenyl)methyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(4-propoxyphenyl)methyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[(4-propoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[(4-propoxyphenyl)methyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-(4-propoxybenzyl)ammonium Formula: C18H32NO+ MolecularWeight: 278.45278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]CC1=CC=C(C=C1)OCCC

Isomeric SMILES

CCCC[C@H](CC)C[NH2+]CC1=CC=C(C=C1)OCCC

InChI

InChI=1S/C18H31NO/c1-4-7-8-16(6-3)14-19-15-17-9-11-18(12-10-17)20-13-5-2/h9-12,16,19H,4-8,13-15H2,1-3H3/p+1/t16-/m0/s1