[1-cyclohexyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl] benzoate

Systemtic Name: [1-cyclohexyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl] benzoate Openeye Name: (1-cyclohexyl-2,5-dioxo-pyrrolidin-1-ium-1-yl) benzoate CAS Name: benzoic acid (1-cyclohexyl-2,5-dioxo-1-pyrrolidin-1-iumyl) ester IUPAC Name: (1-cyclohexyl-2,5-dioxopyrrolidin-1-ium-1-yl) benzoate Traditional Name: benzoic acid (1-cyclohexyl-2,5-diketo-pyrrolidin-1-ium-1-yl) ester Formula: C17H20NO4+ MolecularWeight: 302.345

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[N+]2(C(=O)CCC2=O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)[N+]2(C(=O)CCC2=O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H20NO4/c19-15-11-12-16(20)18(15,14-9-5-2-6-10-14)22-17(21)13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2/q+1