N-[5-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-pyrazol-3-yl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[5-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-pyrazol-3-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-(5-indan-5-yl-2-phenyl-pyrazol-3-yl)-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[5-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-3-pyrazolyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[5-(2,3-dihydro-1H-inden-5-yl)-2-phenylpyrazol-3-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(5-indan-5-yl-2-phenyl-pyrazol-3-yl)-2-morpholin-4-ium-4-yl-acetamide Formula: C24H27N4O2+ MolecularWeight: 403.49678

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C3=NN(C(=C3)NC(=O)C[NH+]4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C3=NN(C(=C3)NC(=O)C[NH+]4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C24H26N4O2/c29-24(17-27-11-13-30-14-12-27)25-23-16-22(26-28(23)21-7-2-1-3-8-21)20-10-9-18-5-4-6-19(18)15-20/h1-3,7-10,15-16H,4-6,11-14,17H2,(H,25,29)/p+1