[(2R,3R)-2-(4-nitrophenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] methanesulfonate

Systemtic Name: [(2R,3R)-2-(4-nitrophenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] methanesulfonate Openeye Name: [(2R,3R)-2-(4-nitrophenyl)-4-oxo-chroman-3-yl] methanesulfonate CAS Name: methanesulfonic acid [(2R,3R)-2-(4-nitrophenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2R,3R)-2-(4-nitrophenyl)-4-oxo-2,3-dihydrochromen-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(2R,3R)-4-keto-2-(4-nitrophenyl)chroman-3-yl] ester Formula: C16H13NO7S MolecularWeight: 363.34192

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1C(OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)O[C@@H]1[C@H](OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO7S/c1-25(21,22)24-16-14(18)12-4-2-3-5-13(12)23-15(16)10-6-8-11(9-7-10)17(19)20/h2-9,15-16H,1H3/t15-,16+/m1/s1