dimethyl-[2-[(2S)-4-(1-phenylpyrazol-4-yl)carbonylmorpholin-2-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[(2S)-4-(1-phenylpyrazol-4-yl)carbonylmorpholin-2-yl]ethyl]azanium Openeye Name: dimethyl-[2-[(2S)-4-(1-phenylpyrazole-4-carbonyl)morpholin-2-yl]ethyl]ammonium CAS Name: dimethyl-[2-[(2S)-4-[oxo-(1-phenyl-4-pyrazolyl)methyl]-2-morpholinyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[(2S)-4-(1-phenylpyrazole-4-carbonyl)morpholin-2-yl]ethyl]azanium Traditional Name: dimethyl-[2-[(2S)-4-(1-phenylpyrazole-4-carbonyl)morpholin-2-yl]ethyl]ammonium Formula: C18H25N4O2+ MolecularWeight: 329.4167

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC1CN(CCO1)C(=O)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CC[C@H]1CN(CCO1)C(=O)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H24N4O2/c1-20(2)9-8-17-14-21(10-11-24-17)18(23)15-12-19-22(13-15)16-6-4-3-5-7-16/h3-7,12-13,17H,8-11,14H2,1-2H3/p+1/t17-/m0/s1