(2-oxidanylidenechromen-7-yl) 2-methoxy-5-nitro-benzenesulfonate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 2-methoxy-5-nitro-benzenesulfonate Openeye Name: (2-oxochromen-7-yl) 2-methoxy-5-nitro-benzenesulfonate CAS Name: 2-methoxy-5-nitrobenzenesulfonic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 2-methoxy-5-nitrobenzenesulfonate Traditional Name: 2-methoxy-5-nitro-benzenesulfonic acid (2-ketochromen-7-yl) ester Formula: C16H11NO8S MolecularWeight: 377.32544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C16H11NO8S/c1-23-13-6-4-11(17(19)20)8-15(13)26(21,22)25-12-5-2-10-3-7-16(18)24-14(10)9-12/h2-9H,1H3