[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-[(3S,5S)-5-methylheptan-3-yl]azanium

Systemtic Name: [(2R)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-[(3S,5S)-5-methylheptan-3-yl]azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[(2R)-2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: [(2R)-2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-[(3S,5S)-5-methylheptan-3-yl]ammonium IUPAC Name: [(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-[(3S,5S)-5-methylheptan-3-yl]azanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[(2R)-2-(2-furyl)-2-pyrrolidino-ethyl]ammonium Formula: C18H33N2O+ MolecularWeight: 293.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CC(C1=CC=CO1)N2CCCC2

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+]C[C@H](C1=CC=CO1)N2CCCC2

InChI

InChI=1S/C18H32N2O/c1-4-15(3)13-16(5-2)19-14-17(18-9-8-12-21-18)20-10-6-7-11-20/h8-9,12,15-17,19H,4-7,10-11,13-14H2,1-3H3/p+1/t15-,16-,17+/m0/s1