N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C27H28N5O2+ MolecularWeight: 454.54352

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1C[C@@H](C2=CC=CC=C2)NC(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O2/c33-27(29-25(21-8-3-1-4-9-21)20-31-14-16-34-17-15-31)24-19-32(23-11-5-2-6-12-23)30-26(24)22-10-7-13-28-18-22/h1-13,18-19,25H,14-17,20H2,(H,29,33)/p+1/t25-/m0/s1