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

Systemtic Name: [(3S)-1-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]pyrrolidin-3-yl]-dimethyl-azanium Openeye Name: [(3S)-1-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]pyrrolidin-3-yl]-dimethyl-ammonium CAS Name: [(3S)-1-[[3-(4-cyclohexylphenyl)-1-methyl-4-pyrazolyl]methyl]-3-pyrrolidinyl]-dimethylammonium IUPAC Name: [(3S)-1-[[3-(4-cyclohexylphenyl)-1-methylpyrazol-4-yl]methyl]pyrrolidin-3-yl]-dimethylazanium Traditional Name: [(3S)-1-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]pyrrolidin-3-yl]-dimethyl-ammonium Formula: C23H35N4+ MolecularWeight: 367.5508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)CN4CCC(C4)[NH+](C)C

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)CN4CC[C@@H](C4)[NH+](C)C

InChI

InChI=1S/C23H34N4/c1-25(2)22-13-14-27(17-22)16-21-15-26(3)24-23(21)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h9-12,15,18,22H,4-8,13-14,16-17H2,1-3H3/p+1/t22-/m0/s1