3-(4-cyclohexylphenyl)-4-[[(3S)-3-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]-1-methyl-pyrazole

Systemtic Name: 3-(4-cyclohexylphenyl)-4-[[(3S)-3-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]-1-methyl-pyrazole Openeye Name: 3-(4-cyclohexylphenyl)-4-[[(3S)-3-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]-1-methyl-pyrazole CAS Name: 3-(4-cyclohexylphenyl)-4-[[(3S)-3-(methoxymethyl)-1-pyrrolidin-1-iumyl]methyl]-1-methylpyrazole IUPAC Name: 3-(4-cyclohexylphenyl)-4-[[(3S)-3-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]-1-methylpyrazole Traditional Name: 3-(4-cyclohexylphenyl)-4-[[(3S)-3-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]-1-methyl-pyrazole Formula: C23H34N3O+ MolecularWeight: 368.53556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)C[NH+]4CCC(C4)COC

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)C[NH+]4CC[C@@H](C4)COC

InChI

InChI=1S/C23H33N3O/c1-25-15-22(16-26-13-12-18(14-26)17-27-2)23(24-25)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h8-11,15,18-19H,3-7,12-14,16-17H2,1-2H3/p+1/t18-/m0/s1