trimethyl (2,4-dinitronaphthalen-1-yl)methanetricarboxylate

Systemtic Name: trimethyl (2,4-dinitronaphthalen-1-yl)methanetricarboxylate Openeye Name: trimethyl (2,4-dinitro-1-naphthyl)methanetricarboxylate CAS Name: (2,4-dinitro-1-naphthalenyl)methanetricarboxylic acid trimethyl ester IUPAC Name: trimethyl (2,4-dinitronaphthalen-1-yl)methanetricarboxylate Traditional Name: (2,4-dinitro-1-naphthyl)methanetricarboxylic acid trimethyl ester Formula: C17H14N2O10 MolecularWeight: 406.30046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-])(C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-])(C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H14N2O10/c1-27-14(20)17(15(21)28-2,16(22)29-3)13-10-7-5-4-6-9(10)11(18(23)24)8-12(13)19(25)26/h4-8H,1-3H3