[(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium

Systemtic Name: [(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium Openeye Name: [(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]ammonium CAS Name: [(2R)-2-(dimethylamino)-3-ethylpentyl]-[(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]ammonium IUPAC Name: [(2R)-2-(dimethylamino)-3-ethylpentyl]-[(3R)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]azanium Traditional Name: [(2R)-2-(dimethylamino)-3-ethyl-pentyl]-[(3R)-6-hydroxycoumaran-3-yl]ammonium Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C[NH2+]C1COC2=C1C=CC(=C2)O)N(C)C

Isomeric SMILES

CCC(CC)[C@H](C[NH2+][C@H]1COC2=C1C=CC(=C2)O)N(C)C

InChI

InChI=1S/C17H28N2O2/c1-5-12(6-2)16(19(3)4)10-18-15-11-21-17-9-13(20)7-8-14(15)17/h7-9,12,15-16,18,20H,5-6,10-11H2,1-4H3/p+1/t15-,16-/m0/s1