2-[1-ethyl-4-methylidene-2,5-bis(oxidanylidene)imidazolidin-1-ium-1-yl]propanoate; methoxybenzene

Systemtic Name: 2-[1-ethyl-4-methylidene-2,5-bis(oxidanylidene)imidazolidin-1-ium-1-yl]propanoate; methoxybenzene Openeye Name: anisole; 2-(1-ethyl-4-methylene-2,5-dioxo-imidazolidin-1-ium-1-yl)propanoate CAS Name: 2-(1-ethyl-4-methylene-2,5-dioxo-1-imidazolidin-1-iumyl)propanoate; methoxybenzene IUPAC Name: anisole; 2-(1-ethyl-4-methylidene-2,5-dioxoimidazolidin-1-ium-1-yl)propanoate Traditional Name: anisole; 2-(1-ethyl-2,5-diketo-4-methylene-imidazolidin-1-ium-1-yl)propionate Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=O)C(=C)NC1=O)C(C)C(=O)[O-].COC1=CC=CC=C1

Isomeric SMILES

CC[N+]1(C(=O)C(=C)NC1=O)C(C)C(=O)[O-].COC1=CC=CC=C1

InChI

InChI=1S/C9H12N2O4.C7H8O/c1-4-11(6(3)8(13)14)7(12)5(2)10-9(11)15;1-8-7-5-3-2-4-6-7/h6H,2,4H2,1,3H3,(H-,10,13,14,15);2-6H,1H3