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1-benzofuran-2-ylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium

1-benzofuran-2-ylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium

Systemtic Name:1-benzofuran-2-ylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium
Openeye Name:benzofuran-2-ylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonium
CAS Name:2-benzofuranylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonium
IUPAC Name:1-benzofuran-2-ylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium
Traditional Name:benzofuran-2-ylmethyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonium
Formula: C17H24NO+
MolecularWeight: 258.37856
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CC2=CC3=CC=CC=C3O2


Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)[NH2+]CC2=CC3=CC=CC=C3O2


InChI

InChI=1S/C17H23NO/c1-12-6-5-8-16(13(12)2)18-11-15-10-14-7-3-4-9-17(14)19-15/h3-4,7,9-10,12-13,16,18H,5-6,8,11H2,1-2H3/p+1/t12-,13+,16-/m0/s1


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