4-butanoyl-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-butanoyl-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-butanoyl-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-4-(1-oxobutyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-butanoyl-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-butyryl-N-(3-morpholin-4-ium-4-ylpropyl)-1H-pyrrole-2-carboxamide Formula: C16H26N3O3+ MolecularWeight: 308.39594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CNC(=C1)C(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CCCC(=O)C1=CNC(=C1)C(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C16H25N3O3/c1-2-4-15(20)13-11-14(18-12-13)16(21)17-5-3-6-19-7-9-22-10-8-19/h11-12,18H,2-10H2,1H3,(H,17,21)/p+1