(3S,4S)-1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[(1-methyl-3-phenyl-4-pyrazolyl)methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[(1-methyl-3-phenylpyrazol-4-yl)methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=C2)C[NH+]3CC(C(C3)O)N4CCOCC4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=C2)C[NH+]3C[C@@H]([C@H](C3)O)N4CCOCC4

InChI

InChI=1S/C19H26N4O2/c1-21-11-16(19(20-21)15-5-3-2-4-6-15)12-22-13-17(18(24)14-22)23-7-9-25-10-8-23/h2-6,11,17-18,24H,7-10,12-14H2,1H3/p+1/t17-,18-/m0/s1