N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]cyclohexanecarboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]cyclohexanecarboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-N-[(2-phenyl-3-pyrazolyl)methyl]cyclohexanecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]cyclohexanecarboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]cyclohexanecarboxamide Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC[NH+]2CCOCC2)CC3=CC=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC[NH+]2CCOCC2)CC3=CC=NN3C4=CC=CC=C4

InChI

InChI=1S/C23H32N4O2/c28-23(20-7-3-1-4-8-20)26(14-13-25-15-17-29-18-16-25)19-22-11-12-24-27(22)21-9-5-2-6-10-21/h2,5-6,9-12,20H,1,3-4,7-8,13-19H2/p+1