3-[(5-ethoxycarbonyl-1-ethyl-2,4-dimethyl-pyrrol-3-yl)carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(5-ethoxycarbonyl-1-ethyl-2,4-dimethyl-pyrrol-3-yl)carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[(5-ethoxycarbonyl-1-ethyl-2,4-dimethyl-pyrrole-3-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(5-ethoxycarbonyl-1-ethyl-2,4-dimethyl-3-pyrrolyl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(5-ethoxycarbonyl-1-ethyl-2,4-dimethylpyrrole-3-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(5-carbethoxy-1-ethyl-2,4-dimethyl-pyrrole-3-carbonyl)amino]propyl-dimethyl-ammonium Formula: C17H30N3O3+ MolecularWeight: 324.4384

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)NCCC[NH+](C)C)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)NCCC[NH+](C)C)C

InChI

InChI=1S/C17H29N3O3/c1-7-20-13(4)14(12(3)15(20)17(22)23-8-2)16(21)18-10-9-11-19(5)6/h7-11H2,1-6H3,(H,18,21)/p+1