N-ethyl-5-(indol-1-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)-1H-pyrazole-3-carboxamide

Systemtic Name: N-ethyl-5-(indol-1-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)-1H-pyrazole-3-carboxamide Openeye Name: N-ethyl-5-(indol-1-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)-1H-pyrazole-3-carboxamide CAS Name: N-ethyl-5-(1-indolylmethyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-1H-pyrazole-3-carboxamide IUPAC Name: N-ethyl-5-(indol-1-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)-1H-pyrazole-3-carboxamide Traditional Name: N-ethyl-5-(indol-1-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)-1H-pyrazole-3-carboxamide Formula: C21H28N5O+ MolecularWeight: 366.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC[NH+]1CCCC1)C(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

Isomeric SMILES

CCN(CC[NH+]1CCCC1)C(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

InChI

InChI=1S/C21H27N5O/c1-2-25(14-13-24-10-5-6-11-24)21(27)19-15-18(22-23-19)16-26-12-9-17-7-3-4-8-20(17)26/h3-4,7-9,12,15H,2,5-6,10-11,13-14,16H2,1H3,(H,22,23)/p+1