5-(indol-1-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(indol-1-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrazole-3-carboxamide Openeye Name: 5-(indol-1-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrazole-3-carboxamide CAS Name: 5-(1-indolylmethyl)-N-[3-(4-morpholin-4-iumyl)propyl]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(indol-1-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrazole-3-carboxamide Traditional Name: 5-(indol-1-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrazole-3-carboxamide Formula: C20H26N5O2+ MolecularWeight: 368.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

InChI

InChI=1S/C20H25N5O2/c26-20(21-7-3-8-24-10-12-27-13-11-24)18-14-17(22-23-18)15-25-9-6-16-4-1-2-5-19(16)25/h1-2,4-6,9,14H,3,7-8,10-13,15H2,(H,21,26)(H,22,23)/p+1