4-ethanoyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrole-2-carboxamide Openeye Name: 4-acetyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrole-2-carboxamide CAS Name: 4-acetyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-2-pyrrolecarboxamide IUPAC Name: 4-acetyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrole-2-carboxamide Traditional Name: 4-acetyl-1-(4-fluorobenzyl)-3,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)pyrrole-2-carboxamide Formula: C22H29FN3O3+ MolecularWeight: 402.482363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)C)C)CC2=CC=C(C=C2)F)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(N(C(=C1C(=O)C)C)CC2=CC=C(C=C2)F)C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C22H28FN3O3/c1-15-20(17(3)27)16(2)26(14-18-4-6-19(23)7-5-18)21(15)22(28)24-8-9-25-10-12-29-13-11-25/h4-7H,8-14H2,1-3H3,(H,24,28)/p+1