[(2S)-1-[(2,5-diphenylpyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]methanol

Systemtic Name: [(2S)-1-[(2,5-diphenylpyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]methanol Openeye Name: [(2S)-1-[(2,5-diphenylpyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]methanol CAS Name: [(2S)-1-[(2,5-diphenyl-3-pyrazolyl)methyl]-2-pyrrolidin-1-iumyl]methanol IUPAC Name: [(2S)-1-[(2,5-diphenylpyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]methanol Traditional Name: [(2S)-1-[(2,5-diphenylpyrazol-3-yl)methyl]pyrrolidin-1-ium-2-yl]methanol Formula: C21H24N3O+ MolecularWeight: 334.43476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)CO

Isomeric SMILES

C1C[C@H]([NH+](C1)CC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)CO

InChI

InChI=1S/C21H23N3O/c25-16-19-12-7-13-23(19)15-20-14-21(17-8-3-1-4-9-17)22-24(20)18-10-5-2-6-11-18/h1-6,8-11,14,19,25H,7,12-13,15-16H2/p+1/t19-/m0/s1