1-benzofuran-2-ylmethyl-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]azanium Openeye Name: benzofuran-2-ylmethyl-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]ammonium CAS Name: 2-benzofuranylmethyl-[(2R)-3-methyl-2-(1-pyrrolidin-1-iumyl)butyl]ammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-ylbutyl]azanium Traditional Name: benzofuran-2-ylmethyl-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]ammonium Formula: C18H28N2O+2 MolecularWeight: 288.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C[NH2+]CC1=CC2=CC=CC=C2O1)[NH+]3CCCC3

Isomeric SMILES

CC(C)[C@H](C[NH2+]CC1=CC2=CC=CC=C2O1)[NH+]3CCCC3

InChI

InChI=1S/C18H26N2O/c1-14(2)17(20-9-5-6-10-20)13-19-12-16-11-15-7-3-4-8-18(15)21-16/h3-4,7-8,11,14,17,19H,5-6,9-10,12-13H2,1-2H3/p+2/t17-/m0/s1