[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[(2S)-2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: [(2S)-2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: [(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-[(2S)-2-(2-furyl)-2-pyrrolidino-ethyl]ammonium Formula: C17H31N2O+ MolecularWeight: 279.44084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2O/c1-14(2)8-9-15(3)18-13-16(17-7-6-12-20-17)19-10-4-5-11-19/h6-7,12,14-16,18H,4-5,8-11,13H2,1-3H3/p+1/t15-,16-/m0/s1