4-ethanoyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-1H-pyrrole-2-carboxamide Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3

InChI

InChI=1S/C19H23N3O3/c1-14(23)17-10-18(20-12-17)19(24)21-11-15-4-2-3-5-16(15)13-22-6-8-25-9-7-22/h2-5,10,12,20H,6-9,11,13H2,1H3,(H,21,24)/p+1