[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(2,4-dinitrophenoxy)benzoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(2,4-dinitrophenoxy)benzoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 3-(2,4-dinitrophenoxy)benzoate CAS Name: 3-(2,4-dinitrophenoxy)benzoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 3-(2,4-dinitrophenoxy)benzoate Traditional Name: 3-(2,4-dinitrophenoxy)benzoic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C23H18N2O8 MolecularWeight: 450.39762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C23H18N2O8/c1-14-6-7-16(10-15(14)2)21(26)13-32-23(27)17-4-3-5-19(11-17)33-22-9-8-18(24(28)29)12-20(22)25(30)31/h3-12H,13H2,1-2H3