N-(2-morpholin-4-ium-4-ylethyl)-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]benzamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]benzamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]benzamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]benzamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]benzamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]benzamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN(CC2=C(NN=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCN(CC2=C(NN=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2/c28-23(20-9-5-2-6-10-20)27(12-11-26-13-15-29-16-14-26)18-21-17-24-25-22(21)19-7-3-1-4-8-19/h1-10,17H,11-16,18H2,(H,24,25)/p+1