[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 3-methylbut-2-enoate

Systemtic Name: [2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 3-methylbut-2-enoate Openeye Name: [2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [2-keto-2-(4-methyl-3-nitro-phenyl)ethyl] ester Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C=C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C=C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H15NO5/c1-9(2)6-14(17)20-8-13(16)11-5-4-10(3)12(7-11)15(18)19/h4-7H,8H2,1-3H3