dimethyl 2-methyl-4-nitro-benzene-1,3-disulfonate

Systemtic Name: dimethyl 2-methyl-4-nitro-benzene-1,3-disulfonate Openeye Name: dimethyl 2-methyl-4-nitro-benzene-1,3-disulfonate CAS Name: 2-methyl-4-nitrobenzene-1,3-disulfonic acid dimethyl ester IUPAC Name: dimethyl 2-methyl-4-nitrobenzene-1,3-disulfonate Traditional Name: 2-methyl-4-nitro-benzene-1,3-disulfonic acid dimethyl ester Formula: C9H11NO8S2 MolecularWeight: 325.31554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1S(=O)(=O)OC)[N+](=O)[O-])S(=O)(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1S(=O)(=O)OC)[N+](=O)[O-])S(=O)(=O)OC

InChI

InChI=1S/C9H11NO8S2/c1-6-8(19(13,14)17-2)5-4-7(10(11)12)9(6)20(15,16)18-3/h4-5H,1-3H3