N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C29H31N4O3+ MolecularWeight: 483.58144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[NH+]5CCOCC5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[NH+]5CCOCC5

InChI

InChI=1S/C29H30N4O3/c1-35-25-14-12-22(13-15-25)27(32-16-18-36-19-17-32)20-30-29(34)26-21-33(24-10-6-3-7-11-24)31-28(26)23-8-4-2-5-9-23/h2-15,21,27H,16-20H2,1H3,(H,30,34)/p+1/t27-/m0/s1