2-[[4-(2-ethylbutanoyl)-1H-pyrrol-2-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-(2-ethylbutanoyl)-1H-pyrrol-2-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-(2-ethylbutanoyl)-1H-pyrrole-2-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-(2-ethyl-1-oxobutyl)-1H-pyrrol-2-yl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(2-ethylbutanoyl)-1H-pyrrole-2-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-(2-ethylbutanoyl)-1H-pyrrole-2-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C15H26N3O2+ MolecularWeight: 280.38584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)C1=CNC(=C1)C(=O)NCC[NH+](C)C

Isomeric SMILES

CCC(CC)C(=O)C1=CNC(=C1)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C15H25N3O2/c1-5-11(6-2)14(19)12-9-13(17-10-12)15(20)16-7-8-18(3)4/h9-11,17H,5-8H2,1-4H3,(H,16,20)/p+1