methyl 2-(6-fluoranyl-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-nitro-benzenesulfonate

Systemtic Name: methyl 2-(6-fluoranyl-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-nitro-benzenesulfonate Openeye Name: methyl 2-(6-fluoro-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-nitro-benzenesulfonate CAS Name: 2-(6-fluoro-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-nitrobenzenesulfonic acid methyl ester IUPAC Name: methyl 2-(6-fluoro-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-nitrobenzenesulfonate Traditional Name: 2-(6-fluoro-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-nitro-benzenesulfonic acid methyl ester Formula: C16H15FN2O6S MolecularWeight: 382.363503

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(OC2=C1C=C(C=C2)F)C3=C(C=CC(=C3)[N+](=O)[O-])S(=O)(=O)OC

Isomeric SMILES

CN1CC(OC2=C1C=C(C=C2)F)C3=C(C=CC(=C3)[N+](=O)[O-])S(=O)(=O)OC

InChI

InChI=1S/C16H15FN2O6S/c1-18-9-15(25-14-5-3-10(17)7-13(14)18)12-8-11(19(20)21)4-6-16(12)26(22,23)24-2/h3-8,15H,9H2,1-2H3