[(2S)-2-(azepan-1-yl)-2-(5-methylfuran-2-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(azepan-1-yl)-2-(5-methylfuran-2-yl)ethyl]azanium Openeye Name: [(2S)-2-(azepan-1-yl)-2-(5-methyl-2-furyl)ethyl]ammonium CAS Name: [(2S)-2-(1-azepanyl)-2-(5-methyl-2-furanyl)ethyl]ammonium IUPAC Name: [(2S)-2-(azepan-1-yl)-2-(5-methylfuran-2-yl)ethyl]azanium Traditional Name: [(2S)-2-(azepan-1-yl)-2-(5-methyl-2-furyl)ethyl]ammonium Formula: C13H23N2O+ MolecularWeight: 223.33452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C[NH3+])N2CCCCCC2

Isomeric SMILES

CC1=CC=C(O1)[C@H](C[NH3+])N2CCCCCC2

InChI

InChI=1S/C13H22N2O/c1-11-6-7-13(16-11)12(10-14)15-8-4-2-3-5-9-15/h6-7,12H,2-5,8-10,14H2,1H3/p+1/t12-/m0/s1