[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] (E)-but-2-enoate

Systemtic Name: [2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] (E)-but-2-enoate Openeye Name: [2-(2,6-dibromo-4-nitro-anilino)-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-(2,6-dibromo-4-nitro-anilino)-2-keto-ethyl] ester Formula: C12H10Br2N2O5 MolecularWeight: 422.0262

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OCC(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br

Isomeric SMILES

C/C=C/C(=O)OCC(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br

InChI

InChI=1S/C12H10Br2N2O5/c1-2-3-11(18)21-6-10(17)15-12-8(13)4-7(16(19)20)5-9(12)14/h2-5H,6H2,1H3,(H,15,17)/b3-2+