1-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)C[NH+]2CCC(CC2)C(=O)N)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)C[NH+]2CCC(CC2)C(=O)N)C

InChI

InChI=1S/C16H25N3O2/c1-4-19-11(2)9-14(12(19)3)15(20)10-18-7-5-13(6-8-18)16(17)21/h9,13H,4-8,10H2,1-3H3,(H2,17,21)/p+1