3-(furan-2-ylmethoxy)propyl-[(3R,5S)-5-methylheptan-3-yl]azanium

Systemtic Name: 3-(furan-2-ylmethoxy)propyl-[(3R,5S)-5-methylheptan-3-yl]azanium Openeye Name: [(1R,3S)-1-ethyl-3-methyl-pentyl]-[3-(2-furylmethoxy)propyl]ammonium CAS Name: 3-(2-furanylmethoxy)propyl-[(3R,5S)-5-methylheptan-3-yl]ammonium IUPAC Name: 3-(furan-2-ylmethoxy)propyl-[(3R,5S)-5-methylheptan-3-yl]azanium Traditional Name: [(1R,3S)-1-ethyl-3-methyl-pentyl]-[3-(2-furfuryloxy)propyl]ammonium Formula: C16H30NO2+ MolecularWeight: 268.4149

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CCCOCC1=CC=CO1

Isomeric SMILES

CC[C@H](C)C[C@@H](CC)[NH2+]CCCOCC1=CC=CO1

InChI

InChI=1S/C16H29NO2/c1-4-14(3)12-15(5-2)17-9-7-10-18-13-16-8-6-11-19-16/h6,8,11,14-15,17H,4-5,7,9-10,12-13H2,1-3H3/p+1/t14-,15+/m0/s1