1-butoxy-4-(4-butoxy-3-nitro-phenyl)sulfonyl-2-nitro-benzene

Systemtic Name: 1-butoxy-4-(4-butoxy-3-nitro-phenyl)sulfonyl-2-nitro-benzene Openeye Name: 1-butoxy-4-(4-butoxy-3-nitro-phenyl)sulfonyl-2-nitro-benzene CAS Name: 1-butoxy-4-(4-butoxy-3-nitrophenyl)sulfonyl-2-nitrobenzene IUPAC Name: 1-butoxy-4-(4-butoxy-3-nitrophenyl)sulfonyl-2-nitrobenzene Traditional Name: 1-butoxy-4-(4-butoxy-3-nitro-phenyl)sulfonyl-2-nitro-benzene Formula: C20H24N2O8S MolecularWeight: 452.47816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)OCCCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)OCCCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O8S/c1-3-5-11-29-19-9-7-15(13-17(19)21(23)24)31(27,28)16-8-10-20(30-12-6-4-2)18(14-16)22(25)26/h7-10,13-14H,3-6,11-12H2,1-2H3