4-[3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butanoate; tetraethylazanium

Systemtic Name: 4-[3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butanoate; tetraethylazanium Openeye Name: 4-(3,5-dioxo-1,2-diphenyl-pyrazolidin-4-yl)butanoate; tetraethylammonium CAS Name: 4-(3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)butanoate; tetraethylammonium IUPAC Name: 4-(3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)butanoate; tetraethylazanium Traditional Name: 4-(3,5-diketo-1,2-diphenyl-pyrazolidin-4-yl)butyrate; tetraethylammonium Formula: C27H37N3O4 MolecularWeight: 467.60038

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC.C1=CC=C(C=C1)N2C(=O)C(C(=O)N2C3=CC=CC=C3)CCCC(=O)[O-]

Isomeric SMILES

CC[N+](CC)(CC)CC.C1=CC=C(C=C1)N2C(=O)C(C(=O)N2C3=CC=CC=C3)CCCC(=O)[O-]

InChI

InChI=1S/C19H18N2O4.C8H20N/c22-17(23)13-7-12-16-18(24)20(14-8-3-1-4-9-14)21(19(16)25)15-10-5-2-6-11-15;1-5-9(6-2,7-3)8-4/h1-6,8-11,16H,7,12-13H2,(H,22,23);5-8H2,1-4H3/q;+1/p-1