1-benzofuran-2-ylmethyl-[(2S)-6-methylheptan-2-yl]azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[(2S)-6-methylheptan-2-yl]azanium Openeye Name: benzofuran-2-ylmethyl-[(1S)-1,5-dimethylhexyl]ammonium CAS Name: 2-benzofuranylmethyl-[(2S)-6-methylheptan-2-yl]ammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[(2S)-6-methylheptan-2-yl]azanium Traditional Name: benzofuran-2-ylmethyl-[(1S)-1,5-dimethylhexyl]ammonium Formula: C17H26NO+ MolecularWeight: 260.39444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO/c1-13(2)7-6-8-14(3)18-12-16-11-15-9-4-5-10-17(15)19-16/h4-5,9-11,13-14,18H,6-8,12H2,1-3H3/p+1/t14-/m0/s1