N-(2-methylsulfonyl-4-nitro-phenyl)-2,4-dinitro-naphthalen-1-amine

Systemtic Name: N-(2-methylsulfonyl-4-nitro-phenyl)-2,4-dinitro-naphthalen-1-amine Openeye Name: N-(2-methylsulfonyl-4-nitro-phenyl)-2,4-dinitro-naphthalen-1-amine CAS Name: N-(2-methylsulfonyl-4-nitrophenyl)-2,4-dinitro-1-naphthalenamine IUPAC Name: N-(2-methylsulfonyl-4-nitrophenyl)-2,4-dinitronaphthalen-1-amine Traditional Name: (2,4-dinitro-1-naphthyl)-(2-mesyl-4-nitro-phenyl)amine Formula: C17H12N4O8S MolecularWeight: 432.36418

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2=C(C=C(C3=CC=CC=C32)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2=C(C=C(C3=CC=CC=C32)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O8S/c1-30(28,29)16-8-10(19(22)23)6-7-13(16)18-17-12-5-3-2-4-11(12)14(20(24)25)9-15(17)21(26)27/h2-9,18H,1H3