1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-morpholin-4-ium-4-yl-ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-morpholin-4-ium-4-yl-ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-morpholin-4-ium-4-yl-ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-morpholin-4-iumyl)ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-morpholin-4-ium-4-ylethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-morpholin-4-ium-4-yl-ethanone Formula: C14H21N2O3+ MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C[NH+]2CCOCC2

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)C[NH+]2CCOCC2

InChI

InChI=1S/C14H20N2O3/c1-9-13(11(3)17)10(2)15-14(9)12(18)8-16-4-6-19-7-5-16/h15H,4-8H2,1-3H3/p+1