[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-hexyl-azanium

Systemtic Name: [(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-hexyl-azanium Openeye Name: [(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-hexyl-ammonium CAS Name: [(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-hexylammonium IUPAC Name: [(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-hexylazanium Traditional Name: [(2R)-5-ethoxy-2-methyl-coumaran-6-yl]methyl-hexyl-ammonium Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]CC1=C(C=C2CC(OC2=C1)C)OCC

Isomeric SMILES

CCCCCC[NH2+]CC1=C(C=C2C[C@H](OC2=C1)C)OCC

InChI

InChI=1S/C18H29NO2/c1-4-6-7-8-9-19-13-16-12-18-15(10-14(3)21-18)11-17(16)20-5-2/h11-12,14,19H,4-10,13H2,1-3H3/p+1/t14-/m1/s1