1-benzofuran-2-ylmethyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: benzofuran-2-ylmethyl-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: 2-benzofuranylmethyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: benzofuran-2-ylmethyl-[(1S)-1,4-dimethylpentyl]ammonium Formula: C16H24NO+ MolecularWeight: 246.36786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC1=CC2=CC=CC=C2O1

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CC1=CC2=CC=CC=C2O1

InChI

InChI=1S/C16H23NO/c1-12(2)8-9-13(3)17-11-15-10-14-6-4-5-7-16(14)18-15/h4-7,10,12-13,17H,8-9,11H2,1-3H3/p+1/t13-/m0/s1