[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-methyl-[(3S)-oxolan-3-yl]azanium

Systemtic Name: [3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-methyl-[(3S)-oxolan-3-yl]azanium Openeye Name: [3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-methyl-[(3S)-tetrahydrofuran-3-yl]ammonium CAS Name: [3-(4-cyclohexylphenyl)-1-methyl-4-pyrazolyl]methyl-methyl-[(3S)-3-oxolanyl]ammonium IUPAC Name: [3-(4-cyclohexylphenyl)-1-methylpyrazol-4-yl]methyl-methyl-[(3S)-oxolan-3-yl]azanium Traditional Name: [3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-methyl-[(3S)-tetrahydrofuran-3-yl]ammonium Formula: C22H32N3O+ MolecularWeight: 354.50898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)C[NH+](C)C4CCOC4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)C[NH+](C)[C@H]4CCOC4

InChI

InChI=1S/C22H31N3O/c1-24(21-12-13-26-16-21)14-20-15-25(2)23-22(20)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h8-11,15,17,21H,3-7,12-14,16H2,1-2H3/p+1/t21-/m0/s1