2-[2-[[ethanoyl-(5-fluoranyl-2-phenoxy-phenyl)amino]methyl]-4-methoxy-phenoxy]ethyl methanesulfonate

Systemtic Name: 2-[2-[[ethanoyl-(5-fluoranyl-2-phenoxy-phenyl)amino]methyl]-4-methoxy-phenoxy]ethyl methanesulfonate Openeye Name: 2-[2-[(N-acetyl-5-fluoro-2-phenoxy-anilino)methyl]-4-methoxy-phenoxy]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[2-[(N-acetyl-5-fluoro-2-phenoxyanilino)methyl]-4-methoxyphenoxy]ethyl ester IUPAC Name: 2-[2-[(N-acetyl-5-fluoro-2-phenoxyanilino)methyl]-4-methoxyphenoxy]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[2-[(N-acetyl-5-fluoro-2-phenoxy-anilino)methyl]-4-methoxy-phenoxy]ethyl ester Formula: C25H26FNO7S MolecularWeight: 503.539843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=C(C=CC(=C1)OC)OCCOS(=O)(=O)C)C2=C(C=CC(=C2)F)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)N(CC1=C(C=CC(=C1)OC)OCCOS(=O)(=O)C)C2=C(C=CC(=C2)F)OC3=CC=CC=C3

InChI

InChI=1S/C25H26FNO7S/c1-18(28)27(23-16-20(26)9-11-25(23)34-21-7-5-4-6-8-21)17-19-15-22(31-2)10-12-24(19)32-13-14-33-35(3,29)30/h4-12,15-16H,13-14,17H2,1-3H3