[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-methyl-azanium

Systemtic Name: [(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-methyl-azanium Openeye Name: [(2R)-2,3-dihydrobenzofuran-2-yl]methyl-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-methyl-ammonium CAS Name: [(2R)-2,3-dihydrobenzofuran-2-yl]methyl-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-methylammonium IUPAC Name: [(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-methylazanium Traditional Name: [(2R)-coumaran-2-yl]methyl-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-methyl-ammonium Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CC[NH+](C)CC2CC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C(=NN1)C)CC[NH+](C)C[C@H]2CC3=CC=CC=C3O2

InChI

InChI=1S/C17H23N3O/c1-12-16(13(2)19-18-12)8-9-20(3)11-15-10-14-6-4-5-7-17(14)21-15/h4-7,15H,8-11H2,1-3H3,(H,18,19)/p+1/t15-/m1/s1