10-fluoranyl-4-propan-2-yl-2,3,4a,5,6,11b-hexahydro-[1]benzoxepino[5,4-b][1,4]oxazine; methanesulfonic acid

Systemtic Name: 10-fluoranyl-4-propan-2-yl-2,3,4a,5,6,11b-hexahydro-[1]benzoxepino[5,4-b][1,4]oxazine; methanesulfonic acid Openeye Name: 10-fluoro-4-isopropyl-2,3,4a,5,6,11b-hexahydro-[1]benzoxepino[5,4-b][1,4]oxazine; methanesulfonic acid CAS Name: 10-fluoro-4-propan-2-yl-2,3,4a,5,6,11b-hexahydro-[1]benzoxepino[5,4-b][1,4]oxazine; methanesulfonic acid IUPAC Name: 10-fluoro-4-propan-2-yl-2,3,4a,5,6,11b-hexahydro-[1]benzoxepino[5,4-b][1,4]oxazine; methanesulfonic acid Traditional Name: 10-fluoro-4-isopropyl-2,3,4a,5,6,11b-hexahydro-[1]benzoxepino[5,4-b][1,4]oxazine; mesylic acid Formula: C16H24FNO5S MolecularWeight: 361.428863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCOC2C1CCOC3=C2C=C(C=C3)F.CS(=O)(=O)O

Isomeric SMILES

CC(C)N1CCOC2C1CCOC3=C2C=C(C=C3)F.CS(=O)(=O)O

InChI

InChI=1S/C15H20FNO2.CH4O3S/c1-10(2)17-6-8-19-15-12-9-11(16)3-4-14(12)18-7-5-13(15)17;1-5(2,3)4/h3-4,9-10,13,15H,5-8H2,1-2H3;1H3,(H,2,3,4)