2-bromanyl-4-[[2-tert-butyl-2-methyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methyl]-6-nitro-phenolate

Systemtic Name: 2-bromanyl-4-[[2-tert-butyl-2-methyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methyl]-6-nitro-phenolate Openeye Name: 2-bromo-4-[(2-tert-butyl-2-methyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-6-nitro-phenolate CAS Name: 2-bromo-4-[(2-tert-butyl-2-methyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-6-nitrophenolate IUPAC Name: 2-bromo-4-[(2-tert-butyl-2-methyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-6-nitrophenolate Traditional Name: 2-bromo-4-[(2-tert-butyl-4,6-diketo-2-methyl-1,3-dioxan-5-ylidene)methyl]-6-nitro-phenolate Formula: C16H15BrNO7- MolecularWeight: 413.1968

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CC2=CC(=C(C(=C2)Br)[O-])[N+](=O)[O-])C(=O)O1)C(C)(C)C

Isomeric SMILES

CC1(OC(=O)C(=CC2=CC(=C(C(=C2)Br)[O-])[N+](=O)[O-])C(=O)O1)C(C)(C)C

InChI

InChI=1S/C16H16BrNO7/c1-15(2,3)16(4)24-13(20)9(14(21)25-16)5-8-6-10(17)12(19)11(7-8)18(22)23/h5-7,19H,1-4H3/p-1