(3S)-3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]piperidin-1-ium Openeye Name: (3S)-3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxymethyl]piperidin-1-ium CAS Name: (3S)-3-[(2,2-dimethyl-3H-benzofuran-7-yl)oxymethyl]piperidin-1-ium IUPAC Name: (3S)-3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]piperidin-1-ium Traditional Name: (3S)-3-[(2,2-dimethylcoumaran-7-yl)oxymethyl]piperidin-1-ium Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC3CCC[NH2+]C3)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OC[C@H]3CCC[NH2+]C3)C

InChI

InChI=1S/C16H23NO2/c1-16(2)9-13-6-3-7-14(15(13)19-16)18-11-12-5-4-8-17-10-12/h3,6-7,12,17H,4-5,8-11H2,1-2H3/p+1/t12-/m0/s1