(2,4-dinitronaphthalen-1-yl) 2-(2-nitrophenyl)sulfinylethanoate

Systemtic Name: (2,4-dinitronaphthalen-1-yl) 2-(2-nitrophenyl)sulfinylethanoate Openeye Name: (2,4-dinitro-1-naphthyl) 2-(2-nitrophenyl)sulfinylacetate CAS Name: 2-(2-nitrophenyl)sulfinylacetic acid (2,4-dinitro-1-naphthalenyl) ester IUPAC Name: (2,4-dinitronaphthalen-1-yl) 2-(2-nitrophenyl)sulfinylacetate Traditional Name: 2-(2-nitrophenyl)sulfinylacetic acid (2,4-dinitro-1-naphthyl) ester Formula: C18H11N3O9S MolecularWeight: 445.35964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2OC(=O)CS(=O)C3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2OC(=O)CS(=O)C3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H11N3O9S/c22-17(10-31(29)16-8-4-3-7-13(16)19(23)24)30-18-12-6-2-1-5-11(12)14(20(25)26)9-15(18)21(27)28/h1-9H,10H2