(4-methyl-2-oxidanylidene-chromen-7-yl) 2-methoxy-5-nitro-benzenesulfonate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 2-methoxy-5-nitro-benzenesulfonate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 2-methoxy-5-nitro-benzenesulfonate CAS Name: 2-methoxy-5-nitrobenzenesulfonic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 2-methoxy-5-nitrobenzenesulfonate Traditional Name: 2-methoxy-5-nitro-benzenesulfonic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C17H13NO8S MolecularWeight: 391.35202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C17H13NO8S/c1-10-7-17(19)25-15-9-12(4-5-13(10)15)26-27(22,23)16-8-11(18(20)21)3-6-14(16)24-2/h3-9H,1-2H3