3,3-dimethyl-2-methylidene-butanoate; 1,2-diphenylethane-1,2-dione

Systemtic Name: 3,3-dimethyl-2-methylidene-butanoate; 1,2-diphenylethane-1,2-dione Openeye Name: 3,3-dimethyl-2-methylene-butanoate; 1,2-diphenylethane-1,2-dione CAS Name: 3,3-dimethyl-2-methylenebutanoate; 1,2-diphenylethane-1,2-dione IUPAC Name: 3,3-dimethyl-2-methylidenebutanoate; 1,2-diphenylethane-1,2-dione Traditional Name: benzil; 2-tert-butylacrylate Formula: C21H21O4- MolecularWeight: 337.38904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C)C(=O)[O-].C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=C)C(=O)[O-].C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H10O2.C7H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-5(6(8)9)7(2,3)4/h1-10H;1H2,2-4H3,(H,8,9)/p-1