[(3S)-1-[(1-phenylpyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(1-phenylpyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(1-phenylpyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(1-phenyl-4-pyrazolyl)methyl]-3-pyrrolidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(1-phenylpyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-[(1-phenylpyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]methanol Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1CO)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1CO)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C15H19N3O/c19-12-13-6-7-17(9-13)10-14-8-16-18(11-14)15-4-2-1-3-5-15/h1-5,8,11,13,19H,6-7,9-10,12H2/p+1/t13-/m0/s1