(4-methyl-2-oxidanylidene-chromen-7-yl) 4-methyl-3-nitro-benzenesulfonate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 4-methyl-3-nitro-benzenesulfonate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 4-methyl-3-nitro-benzenesulfonate CAS Name: 4-methyl-3-nitrobenzenesulfonic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 4-methyl-3-nitrobenzenesulfonate Traditional Name: 4-methyl-3-nitro-benzenesulfonic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C17H13NO7S MolecularWeight: 375.35262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO7S/c1-10-3-5-13(9-15(10)18(20)21)26(22,23)25-12-4-6-14-11(2)7-17(19)24-16(14)8-12/h3-9H,1-2H3