2-morpholin-4-ium-4-yl-N-[2-phenyl-5-(2,4,5-trimethylphenyl)pyrazol-3-yl]ethanamide

Systemtic Name: 2-morpholin-4-ium-4-yl-N-[2-phenyl-5-(2,4,5-trimethylphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-morpholin-4-ium-4-yl-N-[2-phenyl-5-(2,4,5-trimethylphenyl)pyrazol-3-yl]acetamide CAS Name: 2-(4-morpholin-4-iumyl)-N-[2-phenyl-5-(2,4,5-trimethylphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-morpholin-4-ium-4-yl-N-[2-phenyl-5-(2,4,5-trimethylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-morpholin-4-ium-4-yl-N-[2-phenyl-5-(2,4,5-trimethylphenyl)pyrazol-3-yl]acetamide Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NN(C(=C2)NC(=O)C[NH+]3CCOCC3)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN(C(=C2)NC(=O)C[NH+]3CCOCC3)C4=CC=CC=C4)C)C

InChI

InChI=1S/C24H28N4O2/c1-17-13-19(3)21(14-18(17)2)22-15-23(28(26-22)20-7-5-4-6-8-20)25-24(29)16-27-9-11-30-12-10-27/h4-8,13-15H,9-12,16H2,1-3H3,(H,25,29)/p+1