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

Systemtic Name: 1-benzofuran-2-ylmethyl-[(2S)-butan-2-yl]azanium Openeye Name: benzofuran-2-ylmethyl-[(1S)-1-methylpropyl]ammonium CAS Name: 2-benzofuranylmethyl-[(2S)-butan-2-yl]ammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[(2S)-butan-2-yl]azanium Traditional Name: benzofuran-2-ylmethyl-[(1S)-1-methylpropyl]ammonium Formula: C13H18NO+ MolecularWeight: 204.28812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO/c1-3-10(2)14-9-12-8-11-6-4-5-7-13(11)15-12/h4-8,10,14H,3,9H2,1-2H3/p+1/t10-/m0/s1